A0A096N203_PAPAN Loading...

Chromosome 8 open reading frame 82

AlphaFold DB (A0A2K5KVW6), UniProt , Accession A0A096N203, Species PAPAN (Papio anubis, Olive baboon), Gene C8orf82, Length 216 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	33.1	Very low	30.8	Very low	240 Å²	240	166.8 Å²	166.8	100%	1.182	91%	0.912	S	S	*	*				0	87.6	0	-73.6	164.1	79.3	0	0	108.3
2	W	25.8	Very low	30.8	Very low	265 Å²	265	161.3 Å²	161.3	100%	1.004	91%	0.905	S	S	*	*			trans	-103.2	128.7	169.5	-75.1	22.9	0	0	0	105.8
3	S	27.7	Very low	31	Very low	128 Å²	128	161.7 Å²	161.7	90%	0.895	90%	0.902	S	S	*	*			trans	-122.2	121.7	173.8	-148	0	0	0	0	109.2
4	Q	30.9	Very low	31.1	Very low	192 Å²	192	156.7 Å²	156.7	90%	0.897	89%	0.892	S	S	*	*			trans	-66.8	145.3	178.8	-67.3	168.7	-13	0	0	110.1
5	C	29.4	Very low	31	Very low	135 Å²	135	162.5 Å²	162.5	91%	0.912	89%	0.894	S	S	*	*			trans	-136.4	117.1	165.8	-141.5	0	0	0	0	110.8
6	G	31.1	Very low	31.2	Very low	69 Å²	69	159.3 Å²	159.3	71%	0.711	89%	0.886	S	S	*	*			trans	83.9	100.9	137.9	0	0	0	0	0	118	L8	G6-L8 PolarHBondContact O-N 2.79Å
7	A	30.3	Very low	31.3	Very low	109 Å²	109	164.2 Å²	164.2	90%	0.901	89%	0.888	S	S	*	*	P	Polyproline II helix	trans	-57.4	128.2	166.4	0	0	0	0	0	112.3
8	L	32.6	Very low	31.2	Very low	174 Å²	174	158.7 Å²	158.7	91%	0.911	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-79.7	125.2	173.4	-77.4	161.3	0	0	0	110.3	G6	G6-L8 PolarHBondContact O-N 2.79Å
9	R	31.4	Very low	31.4	Very low	236 Å²	236	155.7 Å²	155.7	89%	0.891	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-69.1	128.1	168.8	-72.4	-179.5	170.9	-157.3	-2.6	109.4	L11	R9-L11 PolarHBondContact O-N 2.73Å
10	S	31.7	Very low	31.3	Very low	125 Å²	125	159.4 Å²	159.4	87%	0.874	87%	0.873	S	S	*	*			trans	-66.7	104.5	172.9	38.6	0	0	0	0	110.6
11	L	34.5	Very low	31.4	Very low	162 Å²	162	157 Å²	157	85%	0.848	87%	0.866	S	S	*	*			trans	-84.5	119.1	163.9	-79.8	159.6	0	0	0	108.2	R9 L13	R9-L11 PolarHBondContact O-N 2.73Å; L11-L13 PolarHBondContact O-N 2.97Å; L11-L13 VanDerWaalsContact O-N 3.16Å
12	A	31.1	Very low	31.5	Very low	101 Å²	101	151.6 Å²	151.6	84%	0.835	85%	0.85	S	S	*	*			trans	-58.4	115	177.9	0	0	0	0	0	110.4	A14	A12-A14 PolarHBondContact O-N 3.08Å; A12-A14 VanDerWaalsContact O-N 3.1Å
13	L	33.7	Very low	32.4	Very low	166 Å²	166	143.9 Å²	143.9	87%	0.869	84%	0.837	S	S	*	*			trans	-64.1	108.1	168.4	-84.3	128.7	0	0	0	108.7	L11 R15	L11-L13 PolarHBondContact O-N 2.97Å; L11-L13 VanDerWaalsContact O-N 3.16Å; L13-R15 PolarHBondContact O-N 2.88Å; L13-R15 VanDerWaalsContact O-N 3.11Å
14	A	31.8	Very low	33.1	Very low	92 Å²	92	140.9 Å²	140.9	76%	0.76	83%	0.826	S	S	*	*			trans	-58.5	115.8	162.7	0	0	0	0	0	107.7	A12 S16	A12-A14 PolarHBondContact O-N 3.08Å; A12-A14 VanDerWaalsContact O-N 3.1Å; A14-S16 PolarHBondContact O-N 3.08Å
15	R	30.4	Very low	34.1	Very low	244 Å²	244	139.9 Å²	139.9	92%	0.921	83%	0.827	S	S	*	*			trans	-56.9	101.4	174.9	-76	176.9	166	173.2	-4.4	108.7	L13 R17	L13-R15 PolarHBondContact O-N 2.88Å; L13-R15 VanDerWaalsContact O-N 3.11Å; R15-R17 PolarHBondContact O-N 3.46Å; R15-R17 VanDerWaalsContact O-N 3.09Å
16	S	33.5	Very low	35	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	81%	0.811	S	S	*	*			trans	-58.9	114.7	164.5	54	0	0	0	0	107.1	A14 G18	A14-S16 PolarHBondContact O-N 3.08Å; S16-G18 PolarHBondContact O-N 3.41Å
17	R	33.3	Very low	36.6	Very low	244 Å²	244	137.1 Å²	137.1	92%	0.921	82%	0.821	S	S	*	*			trans	-52.5	114	169.4	-77	177.7	166.6	175.5	-4	106.9	R15 A19	R15-R17 PolarHBondContact O-N 3.46Å; R15-R17 VanDerWaalsContact O-N 3.09Å; R17-A19 PolarHBondContact O-N 2.98Å
18	G	29.1	Very low	39	Very low	64 Å²	64	134.9 Å²	134.9	66%	0.66	80%	0.796	S	S	*	*			trans	-49.8	132.9	178.5	0	0	0	0	0	109.6	S16 R20	S16-G18 PolarHBondContact O-N 3.41Å; G18-R20 PolarHBondContact O-N 3.19Å
19	A	36.1	Very low	41.8	Very low	102 Å²	102	131.8 Å²	131.8	84%	0.843	79%	0.789	S	S	*	*			trans	-51.6	115	164.4	0	0	0	0	0	106.8	R17	R17-A19 PolarHBondContact O-N 2.98Å
20	R	29.2	Very low	44.8	Very low	229 Å²	229	122.8 Å²	122.8	86%	0.864	76%	0.755	S	S	*	*			trans	-54.9	132.9	169.3	-72.8	176.4	171.8	175.5	-3.6	106.3	G18 C22	G18-R20 PolarHBondContact O-N 3.19Å; R20-C22 PolarHBondContact O-N 3.05Å; R20-C22 VanDerWaalsContact O-N 3.09Å
21	P	33.6	Very low	47.8	Very low	111 Å²	111	121.3 Å²	121.3	72%	0.721	74%	0.741	S	S	*	*			trans	-57.1	123.6	162	25.7	-29.6	0	0	0	105.6	S23	P21-S23 PolarHBondContact O-N 3.5Å
22	C	35.3	Very low	50.8	Low	126 Å²	126	115.6 Å²	115.6	85%	0.851	71%	0.71	S	S	*	*			trans	-64.3	86.2	170	-63.9	0	0	0	0	107	R20 G24	R20-C22 PolarHBondContact O-N 3.05Å; R20-C22 VanDerWaalsContact O-N 3.09Å; C22-G24 PolarHBondContact O-N 2.96Å
23	S	42.9	Very low	53.8	Low	103 Å²	103	111.5 Å²	111.5	72%	0.72	68%	0.678	S	S	*	*			trans	-54.6	117.7	156.4	-61.9	0	0	0	0	105.7	P21 D25	P21-S23 PolarHBondContact O-N 3.5Å; S23-D25 PolarHBondContact O-N 3.1Å
24	G	44.1	Very low	56.7	Low	64 Å²	64	105.5 Å²	105.5	66%	0.66	65%	0.645	S	S	*	*			trans	-55.9	112	-176.2	0	0	0	0	0	110.2	C22	C22-G24 PolarHBondContact O-N 2.96Å
25	D	50.8	Low	59.7	Low	172 Å²	172	108.2 Å²	108.2	92%	0.92	64%	0.636	S	S	*	*			trans	-103	112.1	168.4	-167.5	22.7	0	0	0	107.1	S23	S23-D25 PolarHBondContact O-N 3.1Å
26	G	48.3	Very low	62.6	Low	56 Å²	56	99.3 Å²	99.3	58%	0.577	61%	0.61	S	S	*	*	S	Bend	trans	155	50.1	-170.9	0	0	0	0	0	115.3	V28	G26-V28 VanDerWaalsContact C-N 3.34Å; G26-V28 PolarHBondContact O-N 2.84Å
27	G	64.2	Low	65.3	Low	90 Å²	90	97.8 Å²	97.8	93%	0.928	59%	0.59	S	S	*	*			trans	30.7	32.3	144.5	0	0	0	0	0	123.5
28	V	82.4	Confident	67.8	Low	62 Å²	62	92 Å²	92	38%	0.376	58%	0.584	S	S	.	*			trans	-101.1	111.9	176	175.4	0	0	0	0	110.7	G26 Y88 A91	G26-V28 VanDerWaalsContact C-N 3.34Å; G26-V28 PolarHBondContact O-N 2.84Å; V28-Y88 HydrophobicContact CG1-CD1 3.26Å; V28-Y88 HydrophobicContact CG1-CE1 3.43Å; V28-Y88 VanDerWaalsContact CG1-CE1 3.43Å; V28-Y88 HydrophobicContact CG1-CG 4.47Å; V28-A91 HydrophobicContact CB-CB 4.11Å; V28-A91 HydrophobicContact CG1-CB 4.39Å; V28-A91 HydrophobicContact CG2-CB 3.65Å
29	S	90.1	Very high	70.7	Confident	108 Å²	108	95 Å²	95	76%	0.755	58%	0.581	S	S	*	*			trans	-81.1	128.7	174.1	-177.2	0	0	0	0	111.1	Y88	S29-Y88 PolarHBondContact O-OH 2.86Å
30	Y	94.5	Very high	73.3	Confident	47 Å²	47	91.1 Å²	91.1	18%	0.184	55%	0.547	C	S	.	.			trans	-147	163.9	172.3	66	-99	0	0	0	110.3	F44 D56 D57 F92	Y30-F44 HydrophobicContact CD1-CD1 4.11Å; Y30-F44 HydrophobicContact CD1-CE1 4.37Å; Y30-F44 HydrophobicContact CD1-CG 4.21Å; Y30-F44 HydrophobicContact CD2-CB 3.99Å; Y30-F44 HydrophobicContact CD2-CD1 4.16Å; Y30-F44 AromaticContact CD2-CD2 3.21Å; Y30-F44 HydrophobicContact CD2-CD2 3.21Å; Y30-F44 AromaticContact CD2-CE2 3.67Å; Y30-F44 HydrophobicContact CD2-CE2 3.67Å; Y30-F44 AromaticContact CD2-CG 3.5Å; Y30-F44 HydrophobicContact CD2-CG 3.5Å; Y30-F44 VanDerWaalsContact CD2-CG 3.5Å; Y30-F44 HydrophobicContact CD2-CZ 4.29Å; Y30-F44 HydrophobicContact CE1-CB 4.46Å; Y30-F44 HydrophobicContact CE1-CD1 4.49Å; Y30-F44 HydrophobicContact CE1-CG 4.4Å; Y30-F44 HydrophobicContact CE2-CB 3.69Å; Y30-F44 AromaticContact CE2-CD2 3.79Å; Y30-F44 HydrophobicContact CE2-CD2 3.79Å; Y30-F44 AromaticContact CE2-CG 3.75Å; Y30-F44 HydrophobicContact CE2-CG 3.75Å; Y30-F44 AromaticContact CG-CD1 3.93Å; Y30-F44 HydrophobicContact CG-CD1 3.93Å; Y30-F44 AromaticContact CG-CD2 3.69Å; Y30-F44 HydrophobicContact CG-CD2 3.69Å; Y30-F44 HydrophobicContact CG-CE1 4.01Å; Y30-F44 AromaticContact CG-CE2 3.8Å; Y30-F44 HydrophobicContact CG-CE2 3.8Å; Y30-F44 AromaticContact CG-CG 3.77Å; Y30-F44 HydrophobicContact CG-CG 3.77Å; Y30-F44 AromaticContact CG-CZ 3.96Å; Y30-F44 HydrophobicContact CG-CZ 3.96Å; Y30-D56 VanDerWaalsContact OH-CB 3.24Å; Y30-D56 WeakPolarHBondContact OH-CB 3.46Å; Y30-D56 PolarHBondContact OH-OD2 3.17Å; Y30-D57 HydrophobicContact CE2-CB 4.38Å; Y30-D57 PolarHBondContact OH-N 2.8Å; Y30-F92 HydrophobicContact CD1-CE2 4.11Å; Y30-F92 HydrophobicContact CD1-CZ 4.19Å; Y30-F92 HydrophobicContact CE1-CE2 4.02Å; Y30-F92 AromaticContact CE1-CZ 3.7Å; Y30-F92 HydrophobicContact CE1-CZ 3.7Å
31	T	95.5	Very high	76.5	Confident	95 Å²	95	84.5 Å²	84.5	58%	0.583	52%	0.522	S	S	*	.			trans	-127	131.8	170.8	-58.9	0	0	0	0	109.4	G33 Q34	T31-G33 PolarHBondContact O-N 3Å; T31-Q34 VanDerWaalsContact O-CB 3.27Å; T31-Q34 WeakPolarHBondContact O-CB 3.38Å; T31-Q34 VanDerWaalsContact O-CG 3.25Å; T31-Q34 WeakPolarHBondContact O-CG 3.43Å; T31-Q34 PolarHBondContact O-N 3.42Å; T31-Q34 PolarHBondContact O-OE1 3.12Å
32	Q	96.3	Very high	79.5	Confident	41 Å²	41	79.2 Å²	79.2	19%	0.192	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	130.4	177.8	-67.2	-67.7	5.7	0	0	111.1	Q34 F44 D57	Q32-Q34 VanDerWaalsContact C-N 3.29Å; Q32-Q34 PolarHBondContact O-N 3.32Å; Q32-F44 PolarHBondContact NE2-O 3.03Å; Q32-D57 VanDerWaalsContact CG-CG 3.42Å; Q32-D57 WeakPolarHBondContact CG-OD1 3.37Å; Q32-D57 WeakPolarHBondContact CG-OD2 3.47Å; Q32-D57 PolarHBondContact NE2-OD1 3.34Å
33	G	94.8	Very high	82.5	Confident	15 Å²	15	75.8 Å²	75.8	16%	0.155	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	13.8	179.5	0	0	0	0	0	114.7	T31 E42	T31-G33 PolarHBondContact O-N 3Å; G33-E42 VanDerWaalsContact CA-O 3.22Å; G33-E42 WeakPolarHBondContact CA-O 3.17Å; G33-E42 PolarHBondContact N-O 3.29Å
34	Q	95.4	Very high	85.2	Confident	41 Å²	41	70.9 Å²	70.9	19%	0.192	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	155.1	176.4	67	-174.9	21.5	0	0	112.2	T31 Q32 R41 E42 F44 Y88	T31-Q34 VanDerWaalsContact O-CB 3.27Å; T31-Q34 WeakPolarHBondContact O-CB 3.38Å; T31-Q34 VanDerWaalsContact O-CG 3.25Å; T31-Q34 WeakPolarHBondContact O-CG 3.43Å; T31-Q34 PolarHBondContact O-N 3.42Å; T31-Q34 PolarHBondContact O-OE1 3.12Å; Q32-Q34 VanDerWaalsContact C-N 3.29Å; Q32-Q34 PolarHBondContact O-N 3.32Å; Q34-R41 CarbonylContact O-C 3.52Å; Q34-R41 WeakPolarHBondContact O-CA 3.34Å; Q34-E42 HydrophobicContact CG-CB 3.82Å; Q34-E42 HydrophobicContact CG-CG 4.44Å; Q34-E42 PolarHBondContact N-O 3.5Å; Q34-E42 PolarHBondContact NE2-OE2 3.06Å; Q34-E42 PolarHBondContact O-N 2.87Å; Q34-F44 HydrophobicContact CG-CE2 4.42Å; Q34-Y88 PolarHBondContact NE2-OH 2.96Å
35	R	94.8	Very high	87.7	Confident	149 Å²	149	68.4 Å²	68.4	56%	0.562	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	80.8	-175.6	-68.1	178.8	163.2	-154.5	-11.5	110.9	E37 T40 R41	R35-E37 PolarHBondContact O-N 3.26Å; R35-T40 WeakPolarHBondContact CA-O 3.48Å; R35-T40 WeakPolarHBondContact CG-O 3.43Å; R35-R41 HydrophobicContact CG-CG 4.05Å; R35-R41 VanDerWaalsContact NH2-NE 3.14Å
36	P	90.3	Very high	90	Very high	57 Å²	57	61.9 Å²	61.9	37%	0.37	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-24	178.5	31	-37.5	0	0	0	112.6	E42	P36-E42 VanDerWaalsContact CG-CD 3.45Å; P36-E42 HydrophobicContact CG-CG 3.94Å
37	E	89.7	Confident	92.3	Very high	77 Å²	77	59.2 Å²	59.2	36%	0.36	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151.9	-178.4	-66.6	161.8	-143.2	0	0	110.1	R35 Q39 T40 R102	R35-E37 PolarHBondContact O-N 3.26Å; E37-Q39 PolarHBondContact O-N 3.37Å; E37-T40 PolarHBondContact O-N 3.27Å; E37-R102 IonicContact OE1-CZ 3.93Å; E37-R102 IonicContact OE1-NH1 3.56Å; E37-R102 PolarHBondContact OE1-NH1 3.16Å; E37-R102 IonicContact OE1-NH2 3.93Å; E37-R102 PolarHBondContact OE1-NH2 3.32Å; E37-R102 IonicContact OE2-CZ 3.61Å; E37-R102 IonicContact OE2-NH1 3.76Å; E37-R102 IonicContact OE2-NH2 2.69Å; E37-R102 PolarHBondContact OE2-NH2 3.01Å
38	P	87.5	Confident	93.9	Very high	123 Å²	123	55.9 Å²	55.9	80%	0.799	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	133.4	172.6	-24.2	34	0	0	0	111	T40	P38-T40 PolarHBondContact O-N 3.38Å; P38-T40 VanDerWaalsContact O-N 3.13Å
39	Q	88.3	Confident	94.5	Very high	126 Å²	126	55.7 Å²	55.7	59%	0.589	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	3	179.6	-46.6	-174.5	14.1	0	0	116.8	E37 R100	E37-Q39 PolarHBondContact O-N 3.37Å; Q39-R100 VanDerWaalsContact O-CB 3.24Å; Q39-R100 WeakPolarHBondContact O-CB 3.25Å; Q39-R100 WeakPolarHBondContact O-CD 3.39Å; Q39-R100 WeakPolarHBondContact O-CG 2.96Å
40	T	92.1	Very high	94.8	Very high	22 Å²	22	53.5 Å²	53.5	14%	0.135	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.3	177.1	-59.8	0	0	0	0	110.9	R35 E37 P38 R100 R102	R35-T40 WeakPolarHBondContact CA-O 3.48Å; R35-T40 WeakPolarHBondContact CG-O 3.43Å; E37-T40 PolarHBondContact O-N 3.27Å; P38-T40 PolarHBondContact O-N 3.38Å; P38-T40 VanDerWaalsContact O-N 3.13Å; T40-R100 WeakPolarHBondContact CA-O 3.24Å; T40-R102 HydrophobicContact CG2-CG 3.94Å
41	R	96.1	Very high	94.9	Very high	89 Å²	89	51.6 Å²	51.6	34%	0.336	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.5	170.7	-66.9	-178.1	179.5	-85.6	13.8	110.3	Q34 R35 Y43 R100 E101 R102	Q34-R41 CarbonylContact O-C 3.52Å; Q34-R41 WeakPolarHBondContact O-CA 3.34Å; R35-R41 HydrophobicContact CG-CG 4.05Å; R35-R41 VanDerWaalsContact NH2-NE 3.14Å; R41-Y43 HydrophobicContact CB-CE2 3.93Å; R41-R100 PolarHBondContact N-O 2.74Å; R41-E101 HydrophobicContact CB-CG 4.36Å; R41-E101 CarbonylContact O-C 3.59Å; R41-E101 WeakPolarHBondContact O-CA 3.35Å; R41-R102 PolarHBondContact O-N 3.23Å
42	E	97.3	Very high	95	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.1	175.7	-58.3	-171	141.6	0	0	110.6	G33 Q34 P36 F44 R87 R102 F104	G33-E42 VanDerWaalsContact CA-O 3.22Å; G33-E42 WeakPolarHBondContact CA-O 3.17Å; G33-E42 PolarHBondContact N-O 3.29Å; Q34-E42 HydrophobicContact CG-CB 3.82Å; Q34-E42 HydrophobicContact CG-CG 4.44Å; Q34-E42 PolarHBondContact N-O 3.5Å; Q34-E42 PolarHBondContact NE2-OE2 3.06Å; Q34-E42 PolarHBondContact O-N 2.87Å; P36-E42 VanDerWaalsContact CG-CD 3.45Å; P36-E42 HydrophobicContact CG-CG 3.94Å; E42-F44 HydrophobicContact CB-CE2 4.09Å; E42-F44 HydrophobicContact CB-CZ 4.23Å; E42-R87 WeakPolarHBondContact OE1-CD 3.33Å; E42-R87 IonicContact OE1-CZ 2.75Å; E42-R87 IonicContact OE1-NE 3.63Å; E42-R87 PolarHBondContact OE1-NE 3.14Å; E42-R87 IonicContact OE1-NH2 3.62Å; E42-R87 IonicContact OE2-CZ 3.49Å; E42-R87 IonicContact OE2-NE 2.79Å; E42-R87 PolarHBondContact OE2-NE 3.32Å; E42-R87 IonicContact OE2-NH2 3.28Å; E42-R87 PolarHBondContact OE2-NH2 3.21Å; E42-R102 WeakPolarHBondContact CA-O 3.36Å; E42-R102 HydrophobicContact CG-CB 4.31Å; E42-F104 HydrophobicContact CB-CD2 4.34Å; E42-F104 HydrophobicContact CB-CE2 3.91Å; E42-F104 HydrophobicContact CG-CE2 3.84Å
43	Y	97.9	Very high	95.1	Very high	55 Å²	55	48 Å²	48	22%	0.216	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.2	174.8	-68.7	-81.8	0	0	0	109.8	R41 Y45 E101 R102 N103 F104	R41-Y43 HydrophobicContact CB-CE2 3.93Å; Y43-Y45 VanDerWaalsContact CB-CE2 3.48Å; Y43-E101 HydrophobicContact CD2-CB 4.39Å; Y43-E101 HydrophobicContact CD2-CG 4.36Å; Y43-E101 HydrophobicContact CE2-CG 4.08Å; Y43-R102 PolarHBondContact N-O 2.93Å; Y43-N103 CarbonylContact O-C 3.55Å; Y43-N103 WeakPolarHBondContact O-CA 3.49Å; Y43-F104 PolarHBondContact O-N 2.8Å
44	F	98.1	Very high	95.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126	-172.5	-59.5	-93.5	0	0	0	109.7	Y30 Q32 Q34 E42 D56 Y88 F92 F104	Y30-F44 HydrophobicContact CD1-CD1 4.11Å; Y30-F44 HydrophobicContact CD1-CE1 4.37Å; Y30-F44 HydrophobicContact CD1-CG 4.21Å; Y30-F44 HydrophobicContact CD2-CB 3.99Å; Y30-F44 HydrophobicContact CD2-CD1 4.16Å; Y30-F44 AromaticContact CD2-CD2 3.21Å; Y30-F44 HydrophobicContact CD2-CD2 3.21Å; Y30-F44 AromaticContact CD2-CE2 3.67Å; Y30-F44 HydrophobicContact CD2-CE2 3.67Å; Y30-F44 AromaticContact CD2-CG 3.5Å; Y30-F44 HydrophobicContact CD2-CG 3.5Å; Y30-F44 VanDerWaalsContact CD2-CG 3.5Å; Y30-F44 HydrophobicContact CD2-CZ 4.29Å; Y30-F44 HydrophobicContact CE1-CB 4.46Å; Y30-F44 HydrophobicContact CE1-CD1 4.49Å; Y30-F44 HydrophobicContact CE1-CG 4.4Å; Y30-F44 HydrophobicContact CE2-CB 3.69Å; Y30-F44 AromaticContact CE2-CD2 3.79Å; Y30-F44 HydrophobicContact CE2-CD2 3.79Å; Y30-F44 AromaticContact CE2-CG 3.75Å; Y30-F44 HydrophobicContact CE2-CG 3.75Å; Y30-F44 AromaticContact CG-CD1 3.93Å; Y30-F44 HydrophobicContact CG-CD1 3.93Å; Y30-F44 AromaticContact CG-CD2 3.69Å; Y30-F44 HydrophobicContact CG-CD2 3.69Å; Y30-F44 HydrophobicContact CG-CE1 4.01Å; Y30-F44 AromaticContact CG-CE2 3.8Å; Y30-F44 HydrophobicContact CG-CE2 3.8Å; Y30-F44 AromaticContact CG-CG 3.77Å; Y30-F44 HydrophobicContact CG-CG 3.77Å; Y30-F44 AromaticContact CG-CZ 3.96Å; Y30-F44 HydrophobicContact CG-CZ 3.96Å; Q32-F44 PolarHBondContact NE2-O 3.03Å; Q34-F44 HydrophobicContact CG-CE2 4.42Å; E42-F44 HydrophobicContact CB-CE2 4.09Å; E42-F44 HydrophobicContact CB-CZ 4.23Å; F44-D56 HydrophobicContact CB-CB 3.96Å; F44-D56 WeakPolarHBondContact O-CB 3.4Å; F44-D56 PolarHBondContact O-N 3.17Å; F44-Y88 HydrophobicContact CE1-CD1 4.44Å; F44-Y88 AromaticContact CE1-CD2 3.59Å; F44-Y88 HydrophobicContact CE1-CD2 3.59Å; F44-Y88 HydrophobicContact CE1-CE1 4.49Å; F44-Y88 AromaticContact CE1-CE2 3.7Å; F44-Y88 HydrophobicContact CE1-CE2 3.7Å; F44-Y88 AromaticContact CE1-CG 3.97Å; F44-Y88 HydrophobicContact CE1-CG 3.97Å; F44-Y88 AromaticContact CZ-CD2 3.89Å; F44-Y88 HydrophobicContact CZ-CD2 3.89Å; F44-Y88 AromaticContact CZ-CE2 3.51Å; F44-Y88 HydrophobicContact CZ-CE2 3.51Å; F44-Y88 AromaticContact CZ-CZ 3.91Å; F44-F92 HydrophobicContact CB-CE1 3.85Å; F44-F92 HydrophobicContact CB-CZ 3.92Å; F44-F92 HydrophobicContact CD1-CD1 4.18Å; F44-F92 AromaticContact CD1-CD2 3.98Å; F44-F92 HydrophobicContact CD1-CD2 3.98Å; F44-F92 AromaticContact CD1-CE1 3.87Å; F44-F92 HydrophobicContact CD1-CE1 3.87Å; F44-F92 AromaticContact CD1-CE2 3.63Å; F44-F92 HydrophobicContact CD1-CE2 3.63Å; F44-F92 HydrophobicContact CD1-CG 4.24Å; F44-F92 AromaticContact CD1-CZ 3.58Å; F44-F92 HydrophobicContact CD1-CZ 3.58Å; F44-F92 HydrophobicContact CE1-CD2 4.37Å; F44-F92 HydrophobicContact CE1-CE2 4.23Å; F44-F92 HydrophobicContact CG-CE1 4.36Å; F44-F92 HydrophobicContact CG-CZ 4.16Å; F44-F104 HydrophobicContact CD1-CB 3.75Å; F44-F104 HydrophobicContact CD1-CD2 4.09Å; F44-F104 HydrophobicContact CD1-CG 4.2Å; F44-F104 HydrophobicContact CE1-CB 4.05Å; F44-F104 AromaticContact CE1-CD2 3.63Å; F44-F104 HydrophobicContact CE1-CD2 3.63Å; F44-F104 HydrophobicContact CE1-CE2 4.35Å; F44-F104 AromaticContact CE1-CG 3.98Å; F44-F104 HydrophobicContact CE1-CG 3.98Å; F44-F104 AromaticContact CZ-CD2 3.93Å; F44-F104 HydrophobicContact CZ-CD2 3.93Å; F44-F104 HydrophobicContact CZ-CE2 4.36Å
45	Y	98.3	Very high	95.4	Very high	11 Å²	11	47.8 Å²	47.8	4%	0.043	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	155.3	-173.1	-65	-94.3	0	0	0	112	Y43 L53 F54 L55 F67 F72 F76 N103 F104 R106	Y43-Y45 VanDerWaalsContact CB-CE2 3.48Å; Y45-L53 HydrophobicContact CD1-CD1 4.08Å; Y45-L53 HydrophobicContact CD1-CD2 4.15Å; Y45-L53 HydrophobicContact CD1-CG 3.97Å; Y45-L53 HydrophobicContact CG-CD1 4.28Å; Y45-F54 CarbonylContact C-O 3.56Å; Y45-F54 WeakPolarHBondContact CA-O 3.45Å; Y45-F54 WeakPolarHBondContact CB-O 3.08Å; Y45-F54 WeakPolarHBondContact CD1-O 3.22Å; Y45-L55 HydrophobicContact CD1-CD2 4.3Å; Y45-L55 HydrophobicContact CE1-CD2 3.88Å; Y45-F67 HydrophobicContact CD1-CE2 4.06Å; Y45-F67 HydrophobicContact CE1-CD2 4.26Å; Y45-F67 AromaticContact CE1-CE2 3.61Å; Y45-F67 HydrophobicContact CE1-CE2 3.61Å; Y45-F67 AromaticContact CE1-CZ 3.95Å; Y45-F67 HydrophobicContact CE1-CZ 3.95Å; Y45-F72 HydrophobicContact CE1-CE1 4.41Å; Y45-F72 AromaticContact CE1-CZ 3.89Å; Y45-F72 HydrophobicContact CE1-CZ 3.89Å; Y45-F72 AromaticContact CZ-CZ 4Å; Y45-F76 HydrophobicContact CD1-CE2 4.17Å; Y45-F76 AromaticContact CD2-CE2 3.61Å; Y45-F76 HydrophobicContact CD2-CE2 3.61Å; Y45-F76 AromaticContact CD2-CZ 4Å; Y45-F76 HydrophobicContact CD2-CZ 4Å; Y45-F76 HydrophobicContact CE1-CE2 4.35Å; Y45-F76 AromaticContact CE2-CE2 3.81Å; Y45-F76 HydrophobicContact CE2-CE2 3.81Å; Y45-F76 AromaticContact CG-CE2 3.8Å; Y45-F76 HydrophobicContact CG-CE2 3.8Å; Y45-F76 AromaticContact CG-CZ 3.93Å; Y45-F76 HydrophobicContact CG-CZ 3.93Å; Y45-N103 HydrophobicContact CD2-CB 3.92Å; Y45-N103 HydrophobicContact CE2-CB 3.62Å; Y45-F104 PolarHBondContact N-O 3.31Å; Y45-R106 PolarHBondContact O-N 2.67Å
46	Y	97.8	Very high	95.4	Very high	36 Å²	36	41.3 Å²	41.3	14%	0.141	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.5	173.6	177	-94.9	0	0	0	109.5	D48 F54 K61 R106 E108	Y46-D48 HydrophobicContact CE1-CB 3.81Å; Y46-F54 AromaticContact CD1-CD2 3.99Å; Y46-F54 HydrophobicContact CD1-CD2 3.99Å; Y46-F54 PolarHBondContact N-O 3.13Å; Y46-F54 PolarHBondContact O-N 3.13Å; Y46-K61 HydrophobicContact CD1-CD 3.63Å; Y46-K61 HydrophobicContact CE1-CD 4.06Å; Y46-K61 HydrophobicContact CG-CD 4.23Å; Y46-R106 WeakPolarHBondContact CA-O 3.34Å; Y46-R106 HydrophobicContact CD2-CG 4.05Å; Y46-E108 VanDerWaalsContact OH-CB 3.29Å; Y46-E108 WeakPolarHBondContact OH-CB 3.14Å; Y46-E108 WeakPolarHBondContact OH-CG 3.41Å; Y46-E108 PolarHBondContact OH-OE2 3.05Å
47	V	97.9	Very high	95.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.1	167.4	65	0	0	0	0	110.7	Q52 F77 L105 R106 C107 E108	V47-Q52 VanDerWaalsContact CA-O 3.32Å; V47-Q52 WeakPolarHBondContact CA-O 3.45Å; V47-F77 HydrophobicContact CG2-CZ 4.36Å; V47-L105 HydrophobicContact CB-CD1 4.16Å; V47-L105 HydrophobicContact CG1-CD1 4.05Å; V47-L105 HydrophobicContact CG1-CD2 4.25Å; V47-L105 HydrophobicContact CG1-CG 4.43Å; V47-R106 PolarHBondContact N-O 2.84Å; V47-R106 VanDerWaalsContact N-O 3.08Å; V47-C107 HydrophobicContact CG1-CB 3.38Å; V47-C107 WeakPolarHBondContact O-CA 3.49Å; V47-E108 PolarHBondContact O-N 2.69Å
48	D	96.7	Very high	95.7	Very high	19 Å²	19	40.6 Å²	40.6	10%	0.102	21%	0.205	C	C	.	.			trans	-87.6	176.3	179.1	74.4	2	0	0	0	112.6	Y46 Q50 G51 Q52 F54	Y46-D48 HydrophobicContact CE1-CB 3.81Å; D48-Q50 PolarHBondContact O-N 2.77Å; D48-Q50 VanDerWaalsContact OD1-CA 3.3Å; D48-Q50 WeakPolarHBondContact OD1-CA 3.34Å; D48-Q50 WeakPolarHBondContact OD1-CB 3.48Å; D48-Q50 PolarHBondContact OD1-N 2.84Å; D48-G51 PolarHBondContact O-N 3.49Å; D48-G51 VanDerWaalsContact O-N 3.12Å; D48-G51 PolarHBondContact OD1-N 2.91Å; D48-Q52 PolarHBondContact N-O 3.29Å; D48-Q52 VanDerWaalsContact N-O 3.17Å; D48-Q52 WeakPolarHBondContact OD1-CB 3.37Å; D48-Q52 PolarHBondContact OD1-N 3.19Å; D48-F54 HydrophobicContact CB-CE2 4.08Å
49	H	95.3	Very high	95.7	Very high	59 Å²	59	45 Å²	45	27%	0.273	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-6.3	175.2	65.3	-85	0	0	0	114.8	E108 V113 L167	H49-E108 WeakPolarHBondContact CB-OE1 3.21Å; H49-E108 IonicContact CE1-OE2 3.79Å; H49-E108 IonicContact CG-OE1 3.48Å; H49-E108 IonicContact CG-OE2 3.64Å; H49-E108 PolarHBondContact N-OE2 3.28Å; H49-E108 VanDerWaalsContact ND1-CD 3.26Å; H49-E108 IonicContact ND1-OE1 3.07Å; H49-E108 PolarHBondContact ND1-OE1 2.75Å; H49-E108 IonicContact ND1-OE2 2.76Å; H49-E108 PolarHBondContact ND1-OE2 2.79Å; H49-V113 WeakPolarHBondContact O-CG1 3.41Å; H49-L167 HydrophobicContact CB-CD2 3.85Å
50	Q	96.9	Very high	95.7	Very high	62 Å²	62	45.3 Å²	45.3	29%	0.29	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-7	172.6	-60	-63.3	-36.8	0	0	112.1	D48 Q52 T115	D48-Q50 PolarHBondContact O-N 2.77Å; D48-Q50 VanDerWaalsContact OD1-CA 3.3Å; D48-Q50 WeakPolarHBondContact OD1-CA 3.34Å; D48-Q50 WeakPolarHBondContact OD1-CB 3.48Å; D48-Q50 PolarHBondContact OD1-N 2.84Å; Q50-Q52 HydrophobicContact CB-CG 4.12Å; Q50-T115 WeakPolarHBondContact O-CG2 3.34Å
51	G	96.8	Very high	95.7	Very high	7 Å²	7	47.9 Å²	47.9	7%	0.072	22%	0.224	C	C	.	.			trans	80.6	19.8	-175.8	0	0	0	0	0	113.6	D48	D48-G51 PolarHBondContact O-N 3.49Å; D48-G51 VanDerWaalsContact O-N 3.12Å; D48-G51 PolarHBondContact OD1-N 2.91Å
52	Q	97.6	Very high	95.5	Very high	60 Å²	60	46.4 Å²	46.4	28%	0.28	22%	0.223	S	C	.	.			trans	-89	133.8	177.2	-60.7	-176.6	-10.2	0	0	110.1	V47 D48 Q50 F54 C66	V47-Q52 VanDerWaalsContact CA-O 3.32Å; V47-Q52 WeakPolarHBondContact CA-O 3.45Å; D48-Q52 PolarHBondContact N-O 3.29Å; D48-Q52 VanDerWaalsContact N-O 3.17Å; D48-Q52 WeakPolarHBondContact OD1-CB 3.37Å; D48-Q52 PolarHBondContact OD1-N 3.19Å; Q50-Q52 HydrophobicContact CB-CG 4.12Å; Q52-F54 HydrophobicContact CB-CD2 4.46Å; Q52-F54 HydrophobicContact CB-CE2 3.5Å; Q52-F54 VanDerWaalsContact CB-CE2 3.5Å; Q52-F54 HydrophobicContact CB-CZ 3.57Å; Q52-F54 WeakPolarHBondContact O-CD2 3.36Å; Q52-F54 VanDerWaalsContact O-CE2 3.24Å; Q52-F54 WeakPolarHBondContact O-CE2 3.49Å; Q52-C66 HydrophobicContact CB-CB 4Å
53	L	98.1	Very high	95.1	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	135.6	179.7	-173.4	68	0	0	0	110.3	Y45 C66 F67 F72 L73 F76 F77 L105	Y45-L53 HydrophobicContact CD1-CD1 4.08Å; Y45-L53 HydrophobicContact CD1-CD2 4.15Å; Y45-L53 HydrophobicContact CD1-CG 3.97Å; Y45-L53 HydrophobicContact CG-CD1 4.28Å; L53-C66 CarbonylContact O-C 3.46Å; L53-C66 WeakPolarHBondContact O-CA 3.35Å; L53-F67 HydrophobicContact CB-CB 4.49Å; L53-F67 HydrophobicContact CG-CD2 4.3Å; L53-F67 WeakPolarHBondContact O-CD2 3.16Å; L53-F67 PolarHBondContact O-N 3.21Å; L53-F72 HydrophobicContact CD2-CE1 3.68Å; L53-F72 HydrophobicContact CD2-CZ 4.26Å; L53-L73 HydrophobicContact CB-CD2 4.03Å; L53-L73 HydrophobicContact CD2-CD2 3.94Å; L53-F76 HydrophobicContact CD1-CD1 4.49Å; L53-F76 HydrophobicContact CD1-CE1 3.88Å; L53-F76 HydrophobicContact CD1-CZ 3.95Å; L53-F76 HydrophobicContact CD2-CD1 3.92Å; L53-F76 HydrophobicContact CD2-CD2 4.04Å; L53-F76 HydrophobicContact CD2-CE1 4.05Å; L53-F76 HydrophobicContact CD2-CE2 4.13Å; L53-F76 HydrophobicContact CD2-CG 3.93Å; L53-F76 HydrophobicContact CD2-CZ 4.16Å; L53-F77 HydrophobicContact CB-CE2 4.42Å; L53-F77 HydrophobicContact CB-CZ 4.36Å; L53-F77 HydrophobicContact CD1-CZ 4.18Å; L53-F77 HydrophobicContact CD2-CE2 4.26Å; L53-F77 HydrophobicContact CD2-CZ 4.47Å; L53-L105 HydrophobicContact CD1-CD1 3.78Å
54	F	97.8	Very high	94.7	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	158.4	-179.1	-54.1	-90.1	0	0	0	110.7	Y45 Y46 D48 Q52 K61 N62 C66	Y45-F54 CarbonylContact C-O 3.56Å; Y45-F54 WeakPolarHBondContact CA-O 3.45Å; Y45-F54 WeakPolarHBondContact CB-O 3.08Å; Y45-F54 WeakPolarHBondContact CD1-O 3.22Å; Y46-F54 AromaticContact CD1-CD2 3.99Å; Y46-F54 HydrophobicContact CD1-CD2 3.99Å; Y46-F54 PolarHBondContact N-O 3.13Å; Y46-F54 PolarHBondContact O-N 3.13Å; D48-F54 HydrophobicContact CB-CE2 4.08Å; Q52-F54 HydrophobicContact CB-CD2 4.46Å; Q52-F54 HydrophobicContact CB-CE2 3.5Å; Q52-F54 VanDerWaalsContact CB-CE2 3.5Å; Q52-F54 HydrophobicContact CB-CZ 3.57Å; Q52-F54 WeakPolarHBondContact O-CD2 3.36Å; Q52-F54 VanDerWaalsContact O-CE2 3.24Å; Q52-F54 WeakPolarHBondContact O-CE2 3.49Å; F54-K61 HydrophobicContact CB-CD 4.29Å; F54-K61 HydrophobicContact CB-CG 4.19Å; F54-K61 HydrophobicContact CD1-CB 3.9Å; F54-K61 HydrophobicContact CD1-CG 4.07Å; F54-K61 HydrophobicContact CD2-CB 4.36Å; F54-K61 HydrophobicContact CD2-CD 4.4Å; F54-K61 HydrophobicContact CD2-CG 4.47Å; F54-K61 HydrophobicContact CE1-CB 3.91Å; F54-K61 HydrophobicContact CE2-CB 4.36Å; F54-K61 HydrophobicContact CG-CB 4.12Å; F54-K61 HydrophobicContact CG-CD 4.27Å; F54-K61 HydrophobicContact CG-CG 4Å; F54-K61 HydrophobicContact CZ-CB 4.14Å; F54-N62 WeakPolarHBondContact CE1-O 3.45Å; F54-C66 HydrophobicContact CD1-CB 3.93Å; F54-C66 HydrophobicContact CE1-CB 3.45Å; F54-C66 VanDerWaalsContact CE1-CB 3.45Å; F54-C66 HydrophobicContact CZ-CB 3.84Å
55	L	97.3	Very high	94.5	Very high	49 Å²	49	58.2 Å²	58.2	26%	0.257	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	137.8	158.4	-67.7	174.4	0	0	0	108.9	Y45 D57 S58 F67	Y45-L55 HydrophobicContact CD1-CD2 4.3Å; Y45-L55 HydrophobicContact CE1-CD2 3.88Å; L55-D57 VanDerWaalsContact C-N 3.33Å; L55-D57 PolarHBondContact O-N 2.97Å; L55-S58 WeakPolarHBondContact CB-OG 3.42Å; L55-S58 VanDerWaalsContact O-CB 3.25Å; L55-S58 WeakPolarHBondContact O-CB 3.41Å; L55-S58 PolarHBondContact O-N 3.44Å; L55-S58 VanDerWaalsContact O-N 3.15Å; L55-S58 PolarHBondContact O-OG 3.46Å; L55-F67 HydrophobicContact CD2-CE2 4.23Å; L55-F67 HydrophobicContact CD2-CZ 4.18Å; L55-F67 HydrophobicContact CG-CE2 3.96Å; L55-F67 HydrophobicContact CG-CZ 4.03Å
56	D	96.1	Very high	94.3	Very high	14 Å²	14	58.5 Å²	58.5	8%	0.075	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-36.8	-171.5	-172.5	54.3	0	0	0	113.4	Y30 F44 S58 K61 F92 R106	Y30-D56 VanDerWaalsContact OH-CB 3.24Å; Y30-D56 WeakPolarHBondContact OH-CB 3.46Å; Y30-D56 PolarHBondContact OH-OD2 3.17Å; F44-D56 HydrophobicContact CB-CB 3.96Å; F44-D56 WeakPolarHBondContact O-CB 3.4Å; F44-D56 PolarHBondContact O-N 3.17Å; D56-S58 VanDerWaalsContact C-N 3.27Å; D56-S58 PolarHBondContact O-N 2.95Å; D56-K61 WeakPolarHBondContact O-CE 3.35Å; D56-K61 PolarHBondContact O-NZ 2.88Å; D56-F92 HydrophobicContact CB-CE1 4.17Å; D56-F92 HydrophobicContact CB-CZ 4.38Å; D56-F92 WeakPolarHBondContact OD2-CZ 3.5Å; D56-R106 VanDerWaalsContact CG-NE 3.33Å; D56-R106 IonicContact OD1-CZ 3.07Å; D56-R106 IonicContact OD1-NE 2.94Å; D56-R106 PolarHBondContact OD1-NE 3.14Å; D56-R106 IonicContact OD1-NH2 2.69Å; D56-R106 PolarHBondContact OD1-NH2 3.27Å; D56-R106 IonicContact OD2-CZ 3.9Å; D56-R106 IonicContact OD2-NE 3.7Å; D56-R106 PolarHBondContact OD2-NE 2.76Å; D56-R106 IonicContact OD2-NH2 3.57Å
57	D	93.7	Very high	94.3	Very high	88 Å²	88	60 Å²	60	47%	0.471	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	0.2	178.2	66.5	-29.3	0	0	0	113.9	Y30 Q32 L55 K59	Y30-D57 HydrophobicContact CE2-CB 4.38Å; Y30-D57 PolarHBondContact OH-N 2.8Å; Q32-D57 VanDerWaalsContact CG-CG 3.42Å; Q32-D57 WeakPolarHBondContact CG-OD1 3.37Å; Q32-D57 WeakPolarHBondContact CG-OD2 3.47Å; Q32-D57 PolarHBondContact NE2-OD1 3.34Å; L55-D57 VanDerWaalsContact C-N 3.33Å; L55-D57 PolarHBondContact O-N 2.97Å; D57-K59 PolarHBondContact O-N 2.94Å; D57-K59 VanDerWaalsContact O-N 3.14Å
58	S	91.4	Very high	94.1	Very high	31 Å²	31	65.9 Å²	65.9	22%	0.217	32%	0.32	C	S	.	.			trans	-61	119.3	176	-70.4	0	0	0	0	110.7	L55 D56 M60 K61	L55-S58 WeakPolarHBondContact CB-OG 3.42Å; L55-S58 VanDerWaalsContact O-CB 3.25Å; L55-S58 WeakPolarHBondContact O-CB 3.41Å; L55-S58 PolarHBondContact O-N 3.44Å; L55-S58 VanDerWaalsContact O-N 3.15Å; L55-S58 PolarHBondContact O-OG 3.46Å; D56-S58 VanDerWaalsContact C-N 3.27Å; D56-S58 PolarHBondContact O-N 2.95Å; S58-M60 VanDerWaalsContact C-N 3.32Å; S58-M60 PolarHBondContact O-N 3.1Å; S58-K61 PolarHBondContact O-NZ 3.04Å
59	K	88.3	Confident	94.1	Very high	215 Å²	215	69 Å²	69	94%	0.935	34%	0.337	S	S	*	.	S	Bend	trans	-59.4	-41.6	179.9	-67.5	-173.9	179.8	-178.7	0	112.5	D57	D57-K59 PolarHBondContact O-N 2.94Å; D57-K59 VanDerWaalsContact O-N 3.14Å
60	M	88.8	Confident	94.1	Very high	133 Å²	133	70.1 Å²	70.1	66%	0.655	35%	0.35	S	S	*	.			trans	-110.8	129.6	174.8	-63.9	-179	-176.6	0	0	108.3	S58 T65	S58-M60 VanDerWaalsContact C-N 3.32Å; S58-M60 PolarHBondContact O-N 3.1Å; M60-T65 PolarHBondContact O-OG1 2.95Å
61	K	91.4	Very high	94	Very high	76 Å²	76	74.2 Å²	74.2	33%	0.33	37%	0.369	S	S	.	.			trans	-117.1	92.9	173.9	-66.4	-178	174.2	67.2	0	107.9	Y46 F54 D56 S58	Y46-K61 HydrophobicContact CD1-CD 3.63Å; Y46-K61 HydrophobicContact CE1-CD 4.06Å; Y46-K61 HydrophobicContact CG-CD 4.23Å; F54-K61 HydrophobicContact CB-CD 4.29Å; F54-K61 HydrophobicContact CB-CG 4.19Å; F54-K61 HydrophobicContact CD1-CB 3.9Å; F54-K61 HydrophobicContact CD1-CG 4.07Å; F54-K61 HydrophobicContact CD2-CB 4.36Å; F54-K61 HydrophobicContact CD2-CD 4.4Å; F54-K61 HydrophobicContact CD2-CG 4.47Å; F54-K61 HydrophobicContact CE1-CB 3.91Å; F54-K61 HydrophobicContact CE2-CB 4.36Å; F54-K61 HydrophobicContact CG-CB 4.12Å; F54-K61 HydrophobicContact CG-CD 4.27Å; F54-K61 HydrophobicContact CG-CG 4Å; F54-K61 HydrophobicContact CZ-CB 4.14Å; D56-K61 WeakPolarHBondContact O-CE 3.35Å; D56-K61 PolarHBondContact O-NZ 2.88Å; S58-K61 PolarHBondContact O-NZ 3.04Å
62	N	92.1	Very high	94	Very high	58 Å²	58	76.1 Å²	76.1	31%	0.31	38%	0.375	S	S	.	.	S	Bend	trans	-141.6	176.1	-178.4	66.1	38.1	0	0	0	111.3	F54 I64 T65 C66	F54-N62 WeakPolarHBondContact CE1-O 3.45Å; N62-I64 PolarHBondContact O-N 2.91Å; N62-I64 WeakPolarHBondContact OD1-CA 3.32Å; N62-I64 WeakPolarHBondContact OD1-CB 3.31Å; N62-I64 PolarHBondContact OD1-N 3.22Å; N62-T65 PolarHBondContact N-OG1 2.9Å; N62-T65 PolarHBondContact O-N 2.83Å; N62-T65 PolarHBondContact O-OG1 3.35Å; N62-T65 PolarHBondContact OD1-N 3.31Å; N62-T65 PolarHBondContact OD1-OG1 3.06Å; N62-C66 PolarHBondContact O-N 3.09Å
63	F	88.1	Confident	94	Very high	133 Å²	133	73.7 Å²	73.7	58%	0.583	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.5	-176.8	79.5	-84.7	0	0	0	115.2	C66 K68	F63-C66 PolarHBondContact O-SG 3.19Å; F63-K68 WeakPolarHBondContact O-CE 3.41Å; F63-K68 PolarHBondContact O-NZ 2.98Å
64	I	90.4	Very high	94	Very high	116 Å²	116	75.3 Å²	75.3	60%	0.595	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-37.5	175.2	-60.2	-65	0	0	0	110.7	N62	N62-I64 PolarHBondContact O-N 2.91Å; N62-I64 WeakPolarHBondContact OD1-CA 3.32Å; N62-I64 WeakPolarHBondContact OD1-CB 3.31Å; N62-I64 PolarHBondContact OD1-N 3.22Å
65	T	93.1	Very high	93.9	Very high	54 Å²	54	77.1 Å²	77.1	33%	0.331	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-11.9	-174.2	55.1	0	0	0	0	114.9	M60 N62	M60-T65 PolarHBondContact O-OG1 2.95Å; N62-T65 PolarHBondContact N-OG1 2.9Å; N62-T65 PolarHBondContact O-N 2.83Å; N62-T65 PolarHBondContact O-OG1 3.35Å; N62-T65 PolarHBondContact OD1-N 3.31Å; N62-T65 PolarHBondContact OD1-OG1 3.06Å
66	C	95.8	Very high	93.9	Very high	17 Å²	17	74.9 Å²	74.9	12%	0.115	37%	0.373	C	S	.	.	S	Bend	trans	-73	151	179.7	65.1	0	0	0	0	112.2	Q52 L53 F54 N62 F63 K68	Q52-C66 HydrophobicContact CB-CB 4Å; L53-C66 CarbonylContact O-C 3.46Å; L53-C66 WeakPolarHBondContact O-CA 3.35Å; F54-C66 HydrophobicContact CD1-CB 3.93Å; F54-C66 HydrophobicContact CE1-CB 3.45Å; F54-C66 VanDerWaalsContact CE1-CB 3.45Å; F54-C66 HydrophobicContact CZ-CB 3.84Å; N62-C66 PolarHBondContact O-N 3.09Å; F63-C66 PolarHBondContact O-SG 3.19Å; C66-K68 VanDerWaalsContact SG-CE 3.53Å
67	F	96.4	Very high	94	Very high	68 Å²	68	74.4 Å²	74.4	30%	0.298	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-69.4	134.4	169	-70.9	-86.7	0	0	0	110.2	Y45 L53 L55 F72 L73	Y45-F67 HydrophobicContact CD1-CE2 4.06Å; Y45-F67 HydrophobicContact CE1-CD2 4.26Å; Y45-F67 AromaticContact CE1-CE2 3.61Å; Y45-F67 HydrophobicContact CE1-CE2 3.61Å; Y45-F67 AromaticContact CE1-CZ 3.95Å; Y45-F67 HydrophobicContact CE1-CZ 3.95Å; L53-F67 HydrophobicContact CB-CB 4.49Å; L53-F67 HydrophobicContact CG-CD2 4.3Å; L53-F67 WeakPolarHBondContact O-CD2 3.16Å; L53-F67 PolarHBondContact O-N 3.21Å; L55-F67 HydrophobicContact CD2-CE2 4.23Å; L55-F67 HydrophobicContact CD2-CZ 4.18Å; L55-F67 HydrophobicContact CG-CE2 3.96Å; L55-F67 HydrophobicContact CG-CZ 4.03Å; F67-F72 HydrophobicContact CB-CD1 4.09Å; F67-F72 HydrophobicContact CB-CE1 4.01Å; F67-F72 AromaticContact CD1-CD1 3.94Å; F67-F72 HydrophobicContact CD1-CD1 3.94Å; F67-F72 AromaticContact CD1-CE1 3.67Å; F67-F72 HydrophobicContact CD1-CE1 3.67Å; F67-F72 HydrophobicContact CD1-CZ 4.48Å; F67-F72 HydrophobicContact CD2-CE1 4.23Å; F67-F72 HydrophobicContact CE1-CE1 4.18Å; F67-F72 HydrophobicContact CG-CD1 4.13Å; F67-F72 AromaticContact CG-CE1 3.7Å; F67-F72 HydrophobicContact CG-CE1 3.7Å; F67-L73 HydrophobicContact CB-CD2 4.11Å
68	K	94.6	Very high	94.1	Very high	122 Å²	122	71.9 Å²	71.9	53%	0.53	36%	0.36	S	S	.	.			trans	-127.1	-8.2	-178.2	-62.1	175.6	-172.3	170.5	0	113.8	F63 C66 P70	F63-K68 WeakPolarHBondContact O-CE 3.41Å; F63-K68 PolarHBondContact O-NZ 2.98Å; C66-K68 VanDerWaalsContact SG-CE 3.53Å; K68-P70 WeakPolarHBondContact O-CD 3.22Å
69	D	96.3	Very high	94.3	Very high	86 Å²	86	76.2 Å²	76.2	46%	0.46	37%	0.371	S	S	.	.			trans	-65.5	114.8	-179.3	178.3	-102.5	0	0	0	110.1	Q71 F72 L73	D69-Q71 VanDerWaalsContact C-N 3.32Å; D69-Q71 PolarHBondContact O-N 2.97Å; D69-Q71 PolarHBondContact OD1-N 3.32Å; D69-F72 HydrophobicContact CB-CB 4Å; D69-F72 PolarHBondContact O-N 3.42Å; D69-F72 WeakPolarHBondContact OD1-CB 3.27Å; D69-F72 PolarHBondContact OD1-N 2.91Å; D69-L73 WeakPolarHBondContact O-CG 3.22Å; D69-L73 PolarHBondContact O-N 3.12Å
70	P	94.7	Very high	94.8	Very high	81 Å²	81	66 Å²	66	53%	0.526	33%	0.327	S	S	.	.	H	α-helix	trans	-63.1	-37.8	-172.9	-24.6	35.4	0	0	0	112.7	K68 L73 V74	K68-P70 WeakPolarHBondContact O-CD 3.22Å; P70-L73 PolarHBondContact O-N 3.3Å; P70-V74 WeakPolarHBondContact O-CB 3.47Å; P70-V74 WeakPolarHBondContact O-CG2 3.34Å; P70-V74 PolarHBondContact O-N 3.42Å
71	Q	96	Very high	95.1	Very high	149 Å²	149	65.8 Å²	65.8	70%	0.696	32%	0.319	S	S	*	.	H	α-helix	trans	-65.7	-42.3	-178.4	-174.9	177.4	-1.3	0	0	111.3	D69 T75	D69-Q71 VanDerWaalsContact C-N 3.32Å; D69-Q71 PolarHBondContact O-N 2.97Å; D69-Q71 PolarHBondContact OD1-N 3.32Å; Q71-T75 WeakPolarHBondContact O-CB 3.44Å; Q71-T75 PolarHBondContact O-N 3.2Å; Q71-T75 PolarHBondContact O-OG1 3.22Å
72	F	96.3	Very high	95.3	Very high	47 Å²	47	64.7 Å²	64.7	21%	0.206	32%	0.32	C	S	.	.	H	α-helix	trans	-62.1	-51.6	173.6	174.3	-108.3	0	0	0	111.4	Y45 L53 F67 D69 V74 T75 F76	Y45-F72 HydrophobicContact CE1-CE1 4.41Å; Y45-F72 AromaticContact CE1-CZ 3.89Å; Y45-F72 HydrophobicContact CE1-CZ 3.89Å; Y45-F72 AromaticContact CZ-CZ 4Å; L53-F72 HydrophobicContact CD2-CE1 3.68Å; L53-F72 HydrophobicContact CD2-CZ 4.26Å; F67-F72 HydrophobicContact CB-CD1 4.09Å; F67-F72 HydrophobicContact CB-CE1 4.01Å; F67-F72 AromaticContact CD1-CD1 3.94Å; F67-F72 HydrophobicContact CD1-CD1 3.94Å; F67-F72 AromaticContact CD1-CE1 3.67Å; F67-F72 HydrophobicContact CD1-CE1 3.67Å; F67-F72 HydrophobicContact CD1-CZ 4.48Å; F67-F72 HydrophobicContact CD2-CE1 4.23Å; F67-F72 HydrophobicContact CE1-CE1 4.18Å; F67-F72 HydrophobicContact CG-CD1 4.13Å; F67-F72 AromaticContact CG-CE1 3.7Å; F67-F72 HydrophobicContact CG-CE1 3.7Å; D69-F72 HydrophobicContact CB-CB 4Å; D69-F72 PolarHBondContact O-N 3.42Å; D69-F72 WeakPolarHBondContact OD1-CB 3.27Å; D69-F72 PolarHBondContact OD1-N 2.91Å; F72-V74 PolarHBondContact O-N 2.79Å; F72-T75 PolarHBondContact O-N 3.03Å; F72-F76 HydrophobicContact CE2-CD2 4.33Å; F72-F76 AromaticContact CZ-CD2 3.89Å; F72-F76 HydrophobicContact CZ-CD2 3.89Å; F72-F76 VanDerWaalsContact O-CB 3.27Å; F72-F76 WeakPolarHBondContact O-CB 3.38Å; F72-F76 PolarHBondContact O-N 2.71Å
73	L	97.5	Very high	95.5	Very high	9 Å²	9	62.4 Å²	62.4	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-46.3	-179.7	-66.2	177.8	0	0	0	111.4	L53 F67 D69 P70 T75 F76 F77	L53-L73 HydrophobicContact CB-CD2 4.03Å; L53-L73 HydrophobicContact CD2-CD2 3.94Å; F67-L73 HydrophobicContact CB-CD2 4.11Å; D69-L73 WeakPolarHBondContact O-CG 3.22Å; D69-L73 PolarHBondContact O-N 3.12Å; P70-L73 PolarHBondContact O-N 3.3Å; L73-T75 PolarHBondContact O-N 3.24Å; L73-F76 PolarHBondContact O-N 3.15Å; L73-F77 HydrophobicContact CD2-CE2 4.11Å; L73-F77 VanDerWaalsContact O-CD2 3.29Å; L73-F77 WeakPolarHBondContact O-CD2 3.11Å; L73-F77 PolarHBondContact O-N 2.8Å
74	V	97.4	Very high	95.8	Very high	35 Å²	35	66.3 Å²	66.3	21%	0.212	32%	0.318	C	S	.	.	H	α-helix	trans	-58.2	-48.7	175.9	171.4	0	0	0	0	110.4	P70 F72 F76 S78 A135 L136	P70-V74 WeakPolarHBondContact O-CB 3.47Å; P70-V74 WeakPolarHBondContact O-CG2 3.34Å; P70-V74 PolarHBondContact O-N 3.42Å; F72-V74 PolarHBondContact O-N 2.79Å; V74-F76 PolarHBondContact O-N 3.09Å; V74-S78 WeakPolarHBondContact O-CA 3.2Å; V74-S78 WeakPolarHBondContact O-CB 3.5Å; V74-S78 PolarHBondContact O-N 3.35Å; V74-S78 PolarHBondContact O-OG 2.85Å; V74-A135 HydrophobicContact CG1-CB 3.99Å; V74-A135 HydrophobicContact CG2-CB 3.75Å; V74-L136 HydrophobicContact CG2-CG 4.18Å
75	T	96.6	Very high	95.9	Very high	38 Å²	38	62.8 Å²	62.8	23%	0.233	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-44.3	179.5	-59.3	0	0	0	0	111.8	Q71 F72 L73 R79	Q71-T75 WeakPolarHBondContact O-CB 3.44Å; Q71-T75 PolarHBondContact O-N 3.2Å; Q71-T75 PolarHBondContact O-OG1 3.22Å; F72-T75 PolarHBondContact O-N 3.03Å; L73-T75 PolarHBondContact O-N 3.24Å; T75-R79 WeakPolarHBondContact O-CG 3.42Å; T75-R79 PolarHBondContact O-N 2.8Å
76	F	97.7	Very high	95.9	Very high	3 Å²	3	63.4 Å²	63.4	1%	0.013	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-56.8	-177.7	-173.1	-81.8	0	0	0	111.3	Y45 L53 F72 L73 V74 R79 L80 S96 N103 L105	Y45-F76 HydrophobicContact CD1-CE2 4.17Å; Y45-F76 AromaticContact CD2-CE2 3.61Å; Y45-F76 HydrophobicContact CD2-CE2 3.61Å; Y45-F76 AromaticContact CD2-CZ 4Å; Y45-F76 HydrophobicContact CD2-CZ 4Å; Y45-F76 HydrophobicContact CE1-CE2 4.35Å; Y45-F76 AromaticContact CE2-CE2 3.81Å; Y45-F76 HydrophobicContact CE2-CE2 3.81Å; Y45-F76 AromaticContact CG-CE2 3.8Å; Y45-F76 HydrophobicContact CG-CE2 3.8Å; Y45-F76 AromaticContact CG-CZ 3.93Å; Y45-F76 HydrophobicContact CG-CZ 3.93Å; L53-F76 HydrophobicContact CD1-CD1 4.49Å; L53-F76 HydrophobicContact CD1-CE1 3.88Å; L53-F76 HydrophobicContact CD1-CZ 3.95Å; L53-F76 HydrophobicContact CD2-CD1 3.92Å; L53-F76 HydrophobicContact CD2-CD2 4.04Å; L53-F76 HydrophobicContact CD2-CE1 4.05Å; L53-F76 HydrophobicContact CD2-CE2 4.13Å; L53-F76 HydrophobicContact CD2-CG 3.93Å; L53-F76 HydrophobicContact CD2-CZ 4.16Å; F72-F76 HydrophobicContact CE2-CD2 4.33Å; F72-F76 AromaticContact CZ-CD2 3.89Å; F72-F76 HydrophobicContact CZ-CD2 3.89Å; F72-F76 VanDerWaalsContact O-CB 3.27Å; F72-F76 WeakPolarHBondContact O-CB 3.38Å; F72-F76 PolarHBondContact O-N 2.71Å; L73-F76 PolarHBondContact O-N 3.15Å; V74-F76 PolarHBondContact O-N 3.09Å; F76-R79 PolarHBondContact O-N 3Å; F76-L80 HydrophobicContact CE1-CD1 4.22Å; F76-L80 PolarHBondContact O-N 3.21Å; F76-S96 WeakPolarHBondContact O-CB 3.43Å; F76-S96 PolarHBondContact O-OG 3.33Å; F76-N103 HydrophobicContact CD2-CB 4.3Å; F76-N103 HydrophobicContact CE2-CB 3.66Å; F76-N103 HydrophobicContact CZ-CB 4.43Å; F76-L105 HydrophobicContact CE1-CD1 4.2Å; F76-L105 HydrophobicContact CE1-CD2 4.13Å; F76-L105 HydrophobicContact CZ-CB 4.25Å; F76-L105 HydrophobicContact CZ-CD1 4.18Å
77	F	97.4	Very high	95.8	Very high	4 Å²	4	66.3 Å²	66.3	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-76.5	-27.6	-176.3	-70.6	-74.2	0	0	0	112.7	V47 L53 L73 R79 L80 P111 Y129 C130 L136	V47-F77 HydrophobicContact CG2-CZ 4.36Å; L53-F77 HydrophobicContact CB-CE2 4.42Å; L53-F77 HydrophobicContact CB-CZ 4.36Å; L53-F77 HydrophobicContact CD1-CZ 4.18Å; L53-F77 HydrophobicContact CD2-CE2 4.26Å; L53-F77 HydrophobicContact CD2-CZ 4.47Å; L73-F77 HydrophobicContact CD2-CE2 4.11Å; L73-F77 VanDerWaalsContact O-CD2 3.29Å; L73-F77 WeakPolarHBondContact O-CD2 3.11Å; L73-F77 PolarHBondContact O-N 2.8Å; F77-R79 PolarHBondContact O-N 3.3Å; F77-L80 HydrophobicContact CD1-CD2 4.37Å; F77-L80 PolarHBondContact O-N 3.25Å; F77-P111 WeakPolarHBondContact CE1-O 3.37Å; F77-Y129 HydrophobicContact CB-CE2 4.11Å; F77-C130 HydrophobicContact CD1-CB 4.1Å; F77-C130 HydrophobicContact CD2-CB 3.53Å; F77-C130 HydrophobicContact CE1-CB 3.89Å; F77-C130 HydrophobicContact CE2-CB 3.32Å; F77-C130 HydrophobicContact CG-CB 3.94Å; F77-C130 HydrophobicContact CZ-CB 3.5Å; F77-L136 HydrophobicContact CB-CD1 3.59Å; F77-L136 HydrophobicContact CB-CD2 4.28Å; F77-L136 HydrophobicContact CD2-CD1 4.12Å; F77-L136 HydrophobicContact CG-CD1 4.22Å
78	S	96.1	Very high	95.8	Very high	35 Å²	35	65.5 Å²	65.5	25%	0.245	33%	0.325	C	S	.	.	H	α-helix	trans	-68.8	-15.3	174.2	-65	0	0	0	0	113.7	V74 L136 R161	V74-S78 WeakPolarHBondContact O-CA 3.2Å; V74-S78 WeakPolarHBondContact O-CB 3.5Å; V74-S78 PolarHBondContact O-N 3.35Å; V74-S78 PolarHBondContact O-OG 2.85Å; S78-L136 WeakPolarHBondContact OG-CD2 3.32Å; S78-R161 PolarHBondContact O-NH1 2.85Å; S78-R161 PolarHBondContact O-NH2 2.9Å
79	R	96.3	Very high	95.8	Very high	122 Å²	122	63.7 Å²	63.7	46%	0.46	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	1.9	178.7	-64.5	-179.3	-178	166.2	2.1	112.9	T75 F76 F77 R81 P97	T75-R79 WeakPolarHBondContact O-CG 3.42Å; T75-R79 PolarHBondContact O-N 2.8Å; F76-R79 PolarHBondContact O-N 3Å; F77-R79 PolarHBondContact O-N 3.3Å; R79-R81 PolarHBondContact O-N 2.91Å; R79-P97 HydrophobicContact CB-CG 4.48Å; R79-P97 WeakPolarHBondContact CD-O 3.43Å; R79-P97 WeakPolarHBondContact O-CD 3.28Å
80	L	97	Very high	95.5	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.005	34%	0.337	C	S	.	.			trans	-62.9	133.2	-178.3	-162.8	73.5	0	0	0	110.9	F76 F77 F94 L105 P111 R161 A162	F76-L80 HydrophobicContact CE1-CD1 4.22Å; F76-L80 PolarHBondContact O-N 3.21Å; F77-L80 HydrophobicContact CD1-CD2 4.37Å; F77-L80 PolarHBondContact O-N 3.25Å; L80-F94 HydrophobicContact CD1-CB 3.87Å; L80-F94 HydrophobicContact CD2-CB 4.36Å; L80-F94 HydrophobicContact CD2-CD1 4.5Å; L80-F94 HydrophobicContact CD2-CG 4.49Å; L80-F94 HydrophobicContact CG-CB 4.15Å; L80-L105 HydrophobicContact CD1-CB 4.25Å; L80-L105 HydrophobicContact CD1-CD2 3.68Å; L80-L105 HydrophobicContact CD2-CD2 3.76Å; L80-L105 HydrophobicContact CG-CD2 4.38Å; L80-P111 HydrophobicContact CD2-CB 3.48Å; L80-P111 VanDerWaalsContact CD2-CB 3.48Å; L80-P111 HydrophobicContact CD2-CG 4.22Å; L80-R161 WeakPolarHBondContact O-CG 3.24Å; L80-A162 HydrophobicContact CD2-CB 4.32Å
81	R	95.9	Very high	95.5	Very high	127 Å²	127	62.1 Å²	62.1	48%	0.479	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	164.5	178.4	60.7	-177.4	-177.4	-173.9	3	110.7	R79 N83 F94 L95 R161	R79-R81 PolarHBondContact O-N 2.91Å; R81-N83 PolarHBondContact O-N 2.88Å; R81-F94 WeakPolarHBondContact O-CA 3.36Å; R81-L95 WeakPolarHBondContact CG-O 3.4Å; R81-L95 PolarHBondContact N-O 3.48Å; R81-L95 PolarHBondContact O-N 2.88Å; R81-R161 VanDerWaalsContact CA-O 3.26Å; R81-R161 WeakPolarHBondContact CA-O 3.35Å
82	P	96	Very high	95.5	Very high	54 Å²	54	55.2 Å²	55.2	35%	0.351	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	139.6	172.7	-19.6	35.3	0	0	0	109.7	R84 R161	P82-R84 PolarHBondContact O-N 2.79Å; P82-R161 WeakPolarHBondContact CD-O 3.26Å
83	N	96.1	Very high	95.5	Very high	9 Å²	9	55.5 Å²	55.5	5%	0.048	30%	0.299	C	S	.	.			trans	-73.5	113.4	176.7	-175.7	8	0	0	0	109.3	R81 S85 R87 E89 F92 P93 L95 F104	R81-N83 PolarHBondContact O-N 2.88Å; N83-S85 WeakPolarHBondContact OD1-CB 3.34Å; N83-S85 PolarHBondContact OD1-N 2.9Å; N83-S85 VanDerWaalsContact OD1-N 3.09Å; N83-S85 PolarHBondContact OD1-OG 3.42Å; N83-R87 PolarHBondContact ND2-O 3.35Å; N83-E89 WeakPolarHBondContact ND2-CA 3.48Å; N83-F92 VanDerWaalsContact CB-O 3.24Å; N83-F92 WeakPolarHBondContact CB-O 3.28Å; N83-F92 PolarHBondContact ND2-O 3.26Å; N83-P93 WeakPolarHBondContact CB-O 3.15Å; N83-P93 PolarHBondContact N-O 3.35Å; N83-L95 HydrophobicContact CB-CB 4.19Å; N83-F104 WeakPolarHBondContact ND2-CD1 3.26Å
84	R	95	Very high	95.5	Very high	215 Å²	215	56.3 Å²	56.3	81%	0.811	30%	0.302	S	S	*	.			trans	-129.9	32.9	174.2	-60.5	-174.6	179.5	-173.3	-0.3	110.5	P82 G86 E89	P82-R84 PolarHBondContact O-N 2.79Å; R84-G86 VanDerWaalsContact C-N 3.34Å; R84-E89 VanDerWaalsContact CA-OE1 3.22Å; R84-E89 WeakPolarHBondContact CA-OE1 3.33Å
85	S	92.5	Very high	95.5	Very high	43 Å²	43	55 Å²	55	30%	0.301	29%	0.294	S	S	.	.	S	Bend	trans	-85.8	-5.5	-174.1	65.9	0	0	0	0	113.6	N83 R87 E89	N83-S85 WeakPolarHBondContact OD1-CB 3.34Å; N83-S85 PolarHBondContact OD1-N 2.9Å; N83-S85 VanDerWaalsContact OD1-N 3.09Å; N83-S85 PolarHBondContact OD1-OG 3.42Å; S85-R87 PolarHBondContact O-N 3Å; S85-R87 PolarHBondContact OG-N 3.32Å; S85-R87 PolarHBondContact OG-O 2.76Å; S85-E89 PolarHBondContact N-OE1 3.46Å; S85-E89 VanDerWaalsContact N-OE1 3.15Å
86	G	93.2	Very high	95.5	Very high	67 Å²	67	53.2 Å²	53.2	69%	0.691	28%	0.283	S	S	*	.	S	Bend	trans	76	0.5	-168.5	0	0	0	0	0	113.8	R84 E89	R84-G86 VanDerWaalsContact C-N 3.34Å; G86-E89 VanDerWaalsContact CA-OE1 3.27Å; G86-E89 WeakPolarHBondContact CA-OE1 3.1Å; G86-E89 PolarHBondContact N-OE1 2.63Å
87	R	93.5	Very high	95.4	Very high	77 Å²	77	55 Å²	55	29%	0.291	30%	0.295	S	S	.	.	S	Bend	trans	-123.2	129.7	-176.2	-63.3	-179	62	74.7	-0.5	110.5	E42 N83 S85 E89 F104	E42-R87 WeakPolarHBondContact OE1-CD 3.33Å; E42-R87 IonicContact OE1-CZ 2.75Å; E42-R87 IonicContact OE1-NE 3.63Å; E42-R87 PolarHBondContact OE1-NE 3.14Å; E42-R87 IonicContact OE1-NH2 3.62Å; E42-R87 IonicContact OE2-CZ 3.49Å; E42-R87 IonicContact OE2-NE 2.79Å; E42-R87 PolarHBondContact OE2-NE 3.32Å; E42-R87 IonicContact OE2-NH2 3.28Å; E42-R87 PolarHBondContact OE2-NH2 3.21Å; N83-R87 PolarHBondContact ND2-O 3.35Å; S85-R87 PolarHBondContact O-N 3Å; S85-R87 PolarHBondContact OG-N 3.32Å; S85-R87 PolarHBondContact OG-O 2.76Å; R87-E89 PolarHBondContact O-N 2.96Å; R87-F104 HydrophobicContact CB-CE1 4.34Å; R87-F104 HydrophobicContact CB-CZ 4.13Å; R87-F104 WeakPolarHBondContact O-CE1 3.48Å
88	Y	95.1	Very high	95.2	Very high	51 Å²	51	56.7 Å²	56.7	20%	0.2	31%	0.306	C	S	.	.	S	Bend	trans	57.1	18.8	172.2	-53.1	-65.7	0	0	0	115.5	V28 S29 Q34 F44 A90 A91 F92 F104	V28-Y88 HydrophobicContact CG1-CD1 3.26Å; V28-Y88 HydrophobicContact CG1-CE1 3.43Å; V28-Y88 VanDerWaalsContact CG1-CE1 3.43Å; V28-Y88 HydrophobicContact CG1-CG 4.47Å; S29-Y88 PolarHBondContact O-OH 2.86Å; Q34-Y88 PolarHBondContact NE2-OH 2.96Å; F44-Y88 HydrophobicContact CE1-CD1 4.44Å; F44-Y88 AromaticContact CE1-CD2 3.59Å; F44-Y88 HydrophobicContact CE1-CD2 3.59Å; F44-Y88 HydrophobicContact CE1-CE1 4.49Å; F44-Y88 AromaticContact CE1-CE2 3.7Å; F44-Y88 HydrophobicContact CE1-CE2 3.7Å; F44-Y88 AromaticContact CE1-CG 3.97Å; F44-Y88 HydrophobicContact CE1-CG 3.97Å; F44-Y88 AromaticContact CZ-CD2 3.89Å; F44-Y88 HydrophobicContact CZ-CD2 3.89Å; F44-Y88 AromaticContact CZ-CE2 3.51Å; F44-Y88 HydrophobicContact CZ-CE2 3.51Å; F44-Y88 AromaticContact CZ-CZ 3.91Å; Y88-A90 VanDerWaalsContact C-N 3.3Å; Y88-A90 PolarHBondContact O-N 2.92Å; Y88-A91 PolarHBondContact O-N 2.73Å; Y88-A91 VanDerWaalsContact O-N 3.16Å; Y88-F92 WeakPolarHBondContact O-CA 2.97Å; Y88-F92 PolarHBondContact O-N 3.45Å; Y88-F104 HydrophobicContact CD2-CD2 4.36Å; Y88-F104 HydrophobicContact CD2-CE1 4.23Å; Y88-F104 HydrophobicContact CD2-CE2 4.09Å; Y88-F104 HydrophobicContact CD2-CZ 4.01Å
89	E	94.4	Very high	94.9	Very high	84 Å²	84	58.9 Å²	58.9	39%	0.393	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-39.5	-170.8	-61.2	-172.4	175.3	0	0	113.3	N83 R84 S85 G86 R87 F92 P93	N83-E89 WeakPolarHBondContact ND2-CA 3.48Å; R84-E89 VanDerWaalsContact CA-OE1 3.22Å; R84-E89 WeakPolarHBondContact CA-OE1 3.33Å; S85-E89 PolarHBondContact N-OE1 3.46Å; S85-E89 VanDerWaalsContact N-OE1 3.15Å; G86-E89 VanDerWaalsContact CA-OE1 3.27Å; G86-E89 WeakPolarHBondContact CA-OE1 3.1Å; G86-E89 PolarHBondContact N-OE1 2.63Å; R87-E89 PolarHBondContact O-N 2.96Å; E89-F92 CarbonylContact O-C 3.54Å; E89-P93 WeakPolarHBondContact O-CA 3.48Å
90	A	91.5	Very high	94.7	Very high	104 Å²	104	61 Å²	61	86%	0.86	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-41.5	178.8	0	0	0	0	0	112.9	Y88	Y88-A90 VanDerWaalsContact C-N 3.3Å; Y88-A90 PolarHBondContact O-N 2.92Å
91	A	94.3	Very high	94.6	Very high	31 Å²	31	63.7 Å²	63.7	26%	0.256	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-29.4	-177.1	0	0	0	0	0	113.2	V28 Y88 R106	V28-A91 HydrophobicContact CB-CB 4.11Å; V28-A91 HydrophobicContact CG1-CB 4.39Å; V28-A91 HydrophobicContact CG2-CB 3.65Å; Y88-A91 PolarHBondContact O-N 2.73Å; Y88-A91 VanDerWaalsContact O-N 3.16Å; A91-R106 VanDerWaalsContact O-CB 3.29Å; A91-R106 WeakPolarHBondContact O-CB 3.44Å
92	F	96.6	Very high	94.7	Very high	4 Å²	4	60.5 Å²	60.5	2%	0.018	34%	0.343	C	S	.	.			trans	-131	82.9	-178.8	-64.9	-93	0	0	0	109	Y30 F44 D56 N83 Y88 E89 F94 F104 L105 R106	Y30-F92 HydrophobicContact CD1-CE2 4.11Å; Y30-F92 HydrophobicContact CD1-CZ 4.19Å; Y30-F92 HydrophobicContact CE1-CE2 4.02Å; Y30-F92 AromaticContact CE1-CZ 3.7Å; Y30-F92 HydrophobicContact CE1-CZ 3.7Å; F44-F92 HydrophobicContact CB-CE1 3.85Å; F44-F92 HydrophobicContact CB-CZ 3.92Å; F44-F92 HydrophobicContact CD1-CD1 4.18Å; F44-F92 AromaticContact CD1-CD2 3.98Å; F44-F92 HydrophobicContact CD1-CD2 3.98Å; F44-F92 AromaticContact CD1-CE1 3.87Å; F44-F92 HydrophobicContact CD1-CE1 3.87Å; F44-F92 AromaticContact CD1-CE2 3.63Å; F44-F92 HydrophobicContact CD1-CE2 3.63Å; F44-F92 HydrophobicContact CD1-CG 4.24Å; F44-F92 AromaticContact CD1-CZ 3.58Å; F44-F92 HydrophobicContact CD1-CZ 3.58Å; F44-F92 HydrophobicContact CE1-CD2 4.37Å; F44-F92 HydrophobicContact CE1-CE2 4.23Å; F44-F92 HydrophobicContact CG-CE1 4.36Å; F44-F92 HydrophobicContact CG-CZ 4.16Å; D56-F92 HydrophobicContact CB-CE1 4.17Å; D56-F92 HydrophobicContact CB-CZ 4.38Å; D56-F92 WeakPolarHBondContact OD2-CZ 3.5Å; N83-F92 VanDerWaalsContact CB-O 3.24Å; N83-F92 WeakPolarHBondContact CB-O 3.28Å; N83-F92 PolarHBondContact ND2-O 3.26Å; Y88-F92 WeakPolarHBondContact O-CA 2.97Å; Y88-F92 PolarHBondContact O-N 3.45Å; E89-F92 CarbonylContact O-C 3.54Å; F92-F94 PolarHBondContact O-N 3.38Å; F92-F94 VanDerWaalsContact O-N 3.14Å; F92-F104 HydrophobicContact CB-CB 3.74Å; F92-F104 HydrophobicContact CB-CD1 4.32Å; F92-F104 HydrophobicContact CB-CG 4.44Å; F92-F104 HydrophobicContact CD1-CB 3.87Å; F92-F104 HydrophobicContact CG-CB 3.83Å; F92-L105 CarbonylContact C-O 3.59Å; F92-R106 HydrophobicContact CD1-CB 3.96Å; F92-R106 HydrophobicContact CD1-CG 4.08Å; F92-R106 HydrophobicContact CE1-CB 4.3Å; F92-R106 HydrophobicContact CE1-CG 3.91Å
93	P	95.4	Very high	94.8	Very high	53 Å²	53	58 Å²	58	34%	0.344	33%	0.326	S	S	.	.			trans	-70.6	-8	-172.5	26	-33.9	0	0	0	114.1	N83 E89	N83-P93 WeakPolarHBondContact CB-O 3.15Å; N83-P93 PolarHBondContact N-O 3.35Å; E89-P93 WeakPolarHBondContact O-CA 3.48Å
94	F	97.3	Very high	94.9	Very high	26 Å²	26	57.5 Å²	57.5	11%	0.114	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	154	178.1	-58	-81.9	0	0	0	111.8	L80 R81 F92 L105 P111	L80-F94 HydrophobicContact CD1-CB 3.87Å; L80-F94 HydrophobicContact CD2-CB 4.36Å; L80-F94 HydrophobicContact CD2-CD1 4.5Å; L80-F94 HydrophobicContact CD2-CG 4.49Å; L80-F94 HydrophobicContact CG-CB 4.15Å; R81-F94 WeakPolarHBondContact O-CA 3.36Å; F92-F94 PolarHBondContact O-N 3.38Å; F92-F94 VanDerWaalsContact O-N 3.14Å; F94-L105 HydrophobicContact CB-CB 4.06Å; F94-L105 HydrophobicContact CB-CD2 4.25Å; F94-L105 PolarHBondContact N-O 3.42Å; F94-L105 PolarHBondContact O-N 2.84Å; F94-P111 HydrophobicContact CD1-CB 4.49Å; F94-P111 HydrophobicContact CD1-CG 4.19Å; F94-P111 HydrophobicContact CD2-CB 4.01Å; F94-P111 HydrophobicContact CD2-CG 4.1Å; F94-P111 HydrophobicContact CE1-CG 3.78Å; F94-P111 HydrophobicContact CE2-CB 4.06Å; F94-P111 HydrophobicContact CE2-CG 3.69Å; F94-P111 HydrophobicContact CG-CB 4.25Å; F94-P111 HydrophobicContact CG-CG 4.34Å; F94-P111 HydrophobicContact CZ-CB 4.34Å; F94-P111 HydrophobicContact CZ-CG 3.53Å
95	L	97.4	Very high	95	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.037	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	133.7	-179.8	174.8	66.4	0	0	0	109.6	R81 N83 R102 N103 F104	R81-L95 WeakPolarHBondContact CG-O 3.4Å; R81-L95 PolarHBondContact N-O 3.48Å; R81-L95 PolarHBondContact O-N 2.88Å; N83-L95 HydrophobicContact CB-CB 4.19Å; L95-R102 HydrophobicContact CD1-CB 3.92Å; L95-N103 CarbonylContact C-O 3.6Å; L95-N103 WeakPolarHBondContact CA-O 3.49Å; L95-F104 HydrophobicContact CD1-CD1 4.07Å; L95-F104 HydrophobicContact CD1-CE1 4.09Å; L95-F104 HydrophobicContact CD1-CG 4.4Å; L95-F104 HydrophobicContact CD1-CZ 4.41Å
96	S	97.6	Very high	95.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	108.2	169.7	-174.8	0	0	0	0	110.5	F76 N103	F76-S96 WeakPolarHBondContact O-CB 3.43Å; F76-S96 PolarHBondContact O-OG 3.33Å; S96-N103 PolarHBondContact N-O 2.82Å; S96-N103 WeakPolarHBondContact O-CB 3.46Å; S96-N103 PolarHBondContact O-N 2.68Å; S96-N103 VanDerWaalsContact O-N 3.1Å; S96-N103 PolarHBondContact O-ND2 3.45Å
97	P	94.9	Very high	95.3	Very high	41 Å²	41	46.7 Å²	46.7	27%	0.266	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.1	176.4	29.4	-32.5	0	0	0	111.6	R79	R79-P97 HydrophobicContact CB-CG 4.48Å; R79-P97 WeakPolarHBondContact CD-O 3.43Å; R79-P97 WeakPolarHBondContact O-CD 3.28Å
98	C	92.6	Very high	95.4	Very high	38 Å²	38	46.6 Å²	46.6	26%	0.257	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	90.5	176	-166.1	0	0	0	0	111.2	R100 E101	C98-R100 PolarHBondContact O-N 3.22Å; C98-E101 HydrophobicContact CB-CB 4.34Å; C98-E101 PolarHBondContact N-O 3.01Å; C98-E101 WeakPolarHBondContact O-CB 3.48Å; C98-E101 PolarHBondContact O-N 3.27Å
99	G	90.1	Very high	95.4	Very high	81 Å²	81	46 Å²	46	84%	0.835	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	-109.8	-177.6	0	0	0	0	0	111.4	E101	G99-E101 VanDerWaalsContact C-N 3.34Å
100	R	92.4	Very high	95.4	Very high	166 Å²	166	43 Å²	43	63%	0.626	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	3.1	178.3	-78.4	-178.5	174	163	-2.1	113.8	Q39 T40 R41 C98	Q39-R100 VanDerWaalsContact O-CB 3.24Å; Q39-R100 WeakPolarHBondContact O-CB 3.25Å; Q39-R100 WeakPolarHBondContact O-CD 3.39Å; Q39-R100 WeakPolarHBondContact O-CG 2.96Å; T40-R100 WeakPolarHBondContact CA-O 3.24Å; R41-R100 PolarHBondContact N-O 2.74Å; C98-R100 PolarHBondContact O-N 3.22Å
101	E	95.7	Very high	95.7	Very high	58 Å²	58	38.1 Å²	38.1	27%	0.271	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134.3	-174.3	-57.5	176.8	163.9	0	0	111.5	R41 Y43 C98 G99	R41-E101 HydrophobicContact CB-CG 4.36Å; R41-E101 CarbonylContact O-C 3.59Å; R41-E101 WeakPolarHBondContact O-CA 3.35Å; Y43-E101 HydrophobicContact CD2-CB 4.39Å; Y43-E101 HydrophobicContact CD2-CG 4.36Å; Y43-E101 HydrophobicContact CE2-CG 4.08Å; C98-E101 HydrophobicContact CB-CB 4.34Å; C98-E101 PolarHBondContact N-O 3.01Å; C98-E101 WeakPolarHBondContact O-CB 3.48Å; C98-E101 PolarHBondContact O-N 3.27Å; G99-E101 VanDerWaalsContact C-N 3.34Å
102	R	96.5	Very high	95.9	Very high	60 Å²	60	36.7 Å²	36.7	23%	0.226	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	108.1	167.9	-69	-179.2	-172.5	160.4	6.9	107.8	E37 T40 R41 E42 Y43 L95 F104	E37-R102 IonicContact OE1-CZ 3.93Å; E37-R102 IonicContact OE1-NH1 3.56Å; E37-R102 PolarHBondContact OE1-NH1 3.16Å; E37-R102 IonicContact OE1-NH2 3.93Å; E37-R102 PolarHBondContact OE1-NH2 3.32Å; E37-R102 IonicContact OE2-CZ 3.61Å; E37-R102 IonicContact OE2-NH1 3.76Å; E37-R102 IonicContact OE2-NH2 2.69Å; E37-R102 PolarHBondContact OE2-NH2 3.01Å; T40-R102 HydrophobicContact CG2-CG 3.94Å; R41-R102 PolarHBondContact O-N 3.23Å; E42-R102 WeakPolarHBondContact CA-O 3.36Å; E42-R102 HydrophobicContact CG-CB 4.31Å; Y43-R102 PolarHBondContact N-O 2.93Å; L95-R102 HydrophobicContact CD1-CB 3.92Å; R102-F104 HydrophobicContact CB-CE2 3.95Å; R102-F104 HydrophobicContact CB-CZ 4.28Å
103	N	98	Very high	96	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	98.7	-178.2	-55.2	-46.9	0	0	0	109.8	Y43 Y45 F76 L95 S96	Y43-N103 CarbonylContact O-C 3.55Å; Y43-N103 WeakPolarHBondContact O-CA 3.49Å; Y45-N103 HydrophobicContact CD2-CB 3.92Å; Y45-N103 HydrophobicContact CE2-CB 3.62Å; F76-N103 HydrophobicContact CD2-CB 4.3Å; F76-N103 HydrophobicContact CE2-CB 3.66Å; F76-N103 HydrophobicContact CZ-CB 4.43Å; L95-N103 CarbonylContact C-O 3.6Å; L95-N103 WeakPolarHBondContact CA-O 3.49Å; S96-N103 PolarHBondContact N-O 2.82Å; S96-N103 WeakPolarHBondContact O-CB 3.46Å; S96-N103 PolarHBondContact O-N 2.68Å; S96-N103 VanDerWaalsContact O-N 3.1Å; S96-N103 PolarHBondContact O-ND2 3.45Å
104	F	98.3	Very high	96.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	137.4	177.6	-65.5	-79.6	0	0	0	110	E42 Y43 F44 Y45 N83 R87 Y88 F92 L95 R102	E42-F104 HydrophobicContact CB-CD2 4.34Å; E42-F104 HydrophobicContact CB-CE2 3.91Å; E42-F104 HydrophobicContact CG-CE2 3.84Å; Y43-F104 PolarHBondContact O-N 2.8Å; F44-F104 HydrophobicContact CD1-CB 3.75Å; F44-F104 HydrophobicContact CD1-CD2 4.09Å; F44-F104 HydrophobicContact CD1-CG 4.2Å; F44-F104 HydrophobicContact CE1-CB 4.05Å; F44-F104 AromaticContact CE1-CD2 3.63Å; F44-F104 HydrophobicContact CE1-CD2 3.63Å; F44-F104 HydrophobicContact CE1-CE2 4.35Å; F44-F104 AromaticContact CE1-CG 3.98Å; F44-F104 HydrophobicContact CE1-CG 3.98Å; F44-F104 AromaticContact CZ-CD2 3.93Å; F44-F104 HydrophobicContact CZ-CD2 3.93Å; F44-F104 HydrophobicContact CZ-CE2 4.36Å; Y45-F104 PolarHBondContact N-O 3.31Å; N83-F104 WeakPolarHBondContact ND2-CD1 3.26Å; R87-F104 HydrophobicContact CB-CE1 4.34Å; R87-F104 HydrophobicContact CB-CZ 4.13Å; R87-F104 WeakPolarHBondContact O-CE1 3.48Å; Y88-F104 HydrophobicContact CD2-CD2 4.36Å; Y88-F104 HydrophobicContact CD2-CE1 4.23Å; Y88-F104 HydrophobicContact CD2-CE2 4.09Å; Y88-F104 HydrophobicContact CD2-CZ 4.01Å; F92-F104 HydrophobicContact CB-CB 3.74Å; F92-F104 HydrophobicContact CB-CD1 4.32Å; F92-F104 HydrophobicContact CB-CG 4.44Å; F92-F104 HydrophobicContact CD1-CB 3.87Å; F92-F104 HydrophobicContact CG-CB 3.83Å; L95-F104 HydrophobicContact CD1-CD1 4.07Å; L95-F104 HydrophobicContact CD1-CE1 4.09Å; L95-F104 HydrophobicContact CD1-CG 4.4Å; L95-F104 HydrophobicContact CD1-CZ 4.41Å; R102-F104 HydrophobicContact CB-CE2 3.95Å; R102-F104 HydrophobicContact CB-CZ 4.28Å
105	L	98.1	Very high	96.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.6	-178	177.7	75.1	0	0	0	110.4	V47 L53 F76 L80 F92 F94 P111	V47-L105 HydrophobicContact CB-CD1 4.16Å; V47-L105 HydrophobicContact CG1-CD1 4.05Å; V47-L105 HydrophobicContact CG1-CD2 4.25Å; V47-L105 HydrophobicContact CG1-CG 4.43Å; L53-L105 HydrophobicContact CD1-CD1 3.78Å; F76-L105 HydrophobicContact CE1-CD1 4.2Å; F76-L105 HydrophobicContact CE1-CD2 4.13Å; F76-L105 HydrophobicContact CZ-CB 4.25Å; F76-L105 HydrophobicContact CZ-CD1 4.18Å; L80-L105 HydrophobicContact CD1-CB 4.25Å; L80-L105 HydrophobicContact CD1-CD2 3.68Å; L80-L105 HydrophobicContact CD2-CD2 3.76Å; L80-L105 HydrophobicContact CG-CD2 4.38Å; F92-L105 CarbonylContact C-O 3.59Å; F94-L105 HydrophobicContact CB-CB 4.06Å; F94-L105 HydrophobicContact CB-CD2 4.25Å; F94-L105 PolarHBondContact N-O 3.42Å; F94-L105 PolarHBondContact O-N 2.84Å; L105-P111 HydrophobicContact CD2-CB 3.92Å
106	R	96.5	Very high	96.2	Very high	67 Å²	67	37.2 Å²	37.2	25%	0.253	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	158.8	159.2	70.9	178.8	-178	114.8	3	109.9	Y45 Y46 V47 D56 A91 F92	Y45-R106 PolarHBondContact O-N 2.67Å; Y46-R106 WeakPolarHBondContact CA-O 3.34Å; Y46-R106 HydrophobicContact CD2-CG 4.05Å; V47-R106 PolarHBondContact N-O 2.84Å; V47-R106 VanDerWaalsContact N-O 3.08Å; D56-R106 VanDerWaalsContact CG-NE 3.33Å; D56-R106 IonicContact OD1-CZ 3.07Å; D56-R106 IonicContact OD1-NE 2.94Å; D56-R106 PolarHBondContact OD1-NE 3.14Å; D56-R106 IonicContact OD1-NH2 2.69Å; D56-R106 PolarHBondContact OD1-NH2 3.27Å; D56-R106 IonicContact OD2-CZ 3.9Å; D56-R106 IonicContact OD2-NE 3.7Å; D56-R106 PolarHBondContact OD2-NE 2.76Å; D56-R106 IonicContact OD2-NH2 3.57Å; A91-R106 VanDerWaalsContact O-CB 3.29Å; A91-R106 WeakPolarHBondContact O-CB 3.44Å; F92-R106 HydrophobicContact CD1-CB 3.96Å; F92-R106 HydrophobicContact CD1-CG 4.08Å; F92-R106 HydrophobicContact CE1-CB 4.3Å; F92-R106 HydrophobicContact CE1-CG 3.91Å
107	C	95.2	Very high	96.1	Very high	30 Å²	30	39 Å²	39	20%	0.203	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	153.3	-175.2	53.4	0	0	0	0	110.7	V47 D109	V47-C107 HydrophobicContact CG1-CB 3.38Å; V47-C107 WeakPolarHBondContact O-CA 3.49Å; C107-D109 VanDerWaalsContact C-N 3.27Å; C107-D109 PolarHBondContact O-N 3.49Å
108	E	94.5	Very high	96.1	Very high	75 Å²	75	38.9 Å²	38.9	35%	0.35	20%	0.201	S	C	.	.	S	Bend	trans	-63.4	-36.1	171	-162	-174.7	120.9	0	0	112.2	Y46 V47 H49 R153	Y46-E108 VanDerWaalsContact OH-CB 3.29Å; Y46-E108 WeakPolarHBondContact OH-CB 3.14Å; Y46-E108 WeakPolarHBondContact OH-CG 3.41Å; Y46-E108 PolarHBondContact OH-OE2 3.05Å; V47-E108 PolarHBondContact O-N 2.69Å; H49-E108 WeakPolarHBondContact CB-OE1 3.21Å; H49-E108 IonicContact CE1-OE2 3.79Å; H49-E108 IonicContact CG-OE1 3.48Å; H49-E108 IonicContact CG-OE2 3.64Å; H49-E108 PolarHBondContact N-OE2 3.28Å; H49-E108 VanDerWaalsContact ND1-CD 3.26Å; H49-E108 IonicContact ND1-OE1 3.07Å; H49-E108 PolarHBondContact ND1-OE1 2.75Å; H49-E108 IonicContact ND1-OE2 2.76Å; H49-E108 PolarHBondContact ND1-OE2 2.79Å; E108-R153 IonicContact OE1-CZ 3.58Å; E108-R153 IonicContact OE1-NH1 3.87Å; E108-R153 IonicContact OE1-NH2 3.76Å; E108-R153 PolarHBondContact OE1-NH2 2.76Å
109	D	95.3	Very high	96	Very high	38 Å²	38	42.1 Å²	42.1	20%	0.203	22%	0.219	C	C	.	.	S	Bend	trans	-145.6	-66.6	-178.5	-172.6	-37.1	0	0	0	111.1	C107 R153 Y155 L167	C107-D109 VanDerWaalsContact C-N 3.27Å; C107-D109 PolarHBondContact O-N 3.49Å; D109-R153 VanDerWaalsContact CG-NH1 3.34Å; D109-R153 WeakPolarHBondContact OD2-CD 3.49Å; D109-R153 IonicContact OD2-CZ 3.64Å; D109-R153 IonicContact OD2-NE 3.01Å; D109-R153 IonicContact OD2-NH1 3.03Å; D109-R153 PolarHBondContact OD2-NH1 2.97Å; D109-Y155 PolarHBondContact OD1-OH 3.17Å; D109-Y155 PolarHBondContact OD2-OH 3.07Å; D109-L167 HydrophobicContact CB-CD2 4.35Å
110	R	96.1	Very high	95.6	Very high	22 Å²	22	40.3 Å²	40.3	8%	0.083	20%	0.196	C	C	.	.			trans	-126.8	149	176.9	-65.1	-57.7	174.7	149.1	-11.6	111.6	V112 Y155 L167 L209 A213	R110-V112 VanDerWaalsContact C-N 3.26Å; R110-V112 PolarHBondContact O-N 2.84Å; R110-Y155 HydrophobicContact CG-CD1 4.41Å; R110-Y155 HydrophobicContact CG-CE1 4.12Å; R110-L167 HydrophobicContact CB-CB 4.18Å; R110-L167 HydrophobicContact CG-CB 4.38Å; R110-L209 PolarHBondContact NH2-O 3.22Å; R110-A213 VanDerWaalsContact NH2-CB 3.27Å
111	P	96.9	Very high	94.5	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	20%	0.204	C	C	.	.	S	Bend	trans	-71.5	-23.5	175.6	31	-38.1	0	0	0	113	F77 L80 F94 L105 A162	F77-P111 WeakPolarHBondContact CE1-O 3.37Å; L80-P111 HydrophobicContact CD2-CB 3.48Å; L80-P111 VanDerWaalsContact CD2-CB 3.48Å; L80-P111 HydrophobicContact CD2-CG 4.22Å; F94-P111 HydrophobicContact CD1-CB 4.49Å; F94-P111 HydrophobicContact CD1-CG 4.19Å; F94-P111 HydrophobicContact CD2-CB 4.01Å; F94-P111 HydrophobicContact CD2-CG 4.1Å; F94-P111 HydrophobicContact CE1-CG 3.78Å; F94-P111 HydrophobicContact CE2-CB 4.06Å; F94-P111 HydrophobicContact CE2-CG 3.69Å; F94-P111 HydrophobicContact CG-CB 4.25Å; F94-P111 HydrophobicContact CG-CG 4.34Å; F94-P111 HydrophobicContact CZ-CB 4.34Å; F94-P111 HydrophobicContact CZ-CG 3.53Å; L105-P111 HydrophobicContact CD2-CB 3.92Å; P111-A162 HydrophobicContact CG-CB 4.47Å; P111-A162 WeakPolarHBondContact CG-O 3.37Å
112	V	98.3	Very high	93.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.012	24%	0.236	C	C	.	.			trans	-104.3	119.4	175.6	176.4	0	0	0	0	108.1	R110 F114 Y129 A158 A162 G166 L167	R110-V112 VanDerWaalsContact C-N 3.26Å; R110-V112 PolarHBondContact O-N 2.84Å; V112-F114 HydrophobicContact CG1-CD1 4.44Å; V112-F114 HydrophobicContact CG1-CE1 3.93Å; V112-F114 HydrophobicContact CG1-CE2 4.25Å; V112-F114 HydrophobicContact CG1-CZ 3.84Å; V112-Y129 HydrophobicContact CG1-CD1 4.29Å; V112-Y129 HydrophobicContact CG1-CD2 3.94Å; V112-Y129 HydrophobicContact CG1-CG 3.77Å; V112-A158 HydrophobicContact CB-CB 4.04Å; V112-A158 HydrophobicContact CG1-CB 3.93Å; V112-A158 HydrophobicContact CG2-CB 4.24Å; V112-A162 HydrophobicContact CG2-CB 3.53Å; V112-G166 CarbonylContact O-C 3.49Å; V112-G166 WeakPolarHBondContact O-CA 3.49Å; V112-L167 PolarHBondContact O-N 3.13Å
113	V	98.6	Very high	93.1	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	112	174.9	-174.8	0	0	0	0	109.2	H49 T115 Y129 C130 L167 R169	H49-V113 WeakPolarHBondContact O-CG1 3.41Å; V113-T115 PolarHBondContact O-N 3.46Å; V113-Y129 WeakPolarHBondContact O-CA 3.35Å; V113-Y129 VanDerWaalsContact O-CB 3.23Å; V113-Y129 WeakPolarHBondContact O-CB 3.23Å; V113-C130 PolarHBondContact N-SG 3.47Å; V113-C130 VanDerWaalsContact N-SG 3.4Å; V113-C130 PolarHBondContact O-N 3.2Å; V113-L167 CarbonylContact C-O 3.42Å; V113-L167 VanDerWaalsContact CA-O 3.26Å; V113-L167 WeakPolarHBondContact CA-O 3.49Å; V113-L167 HydrophobicContact CG1-CD2 4.38Å; V113-L167 HydrophobicContact CG1-CG 4.47Å; V113-L167 HydrophobicContact CG2-CB 4.33Å; V113-L167 HydrophobicContact CG2-CD2 4.39Å; V113-R169 HydrophobicContact CG1-CB 4.01Å
114	F	98.7	Very high	92.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	125.9	175.2	-59.4	-66.6	0	0	0	109.9	V112 L127 S128 Y129 V138 H156 P157 A158 L167 V168 R169 L172	V112-F114 HydrophobicContact CG1-CD1 4.44Å; V112-F114 HydrophobicContact CG1-CE1 3.93Å; V112-F114 HydrophobicContact CG1-CE2 4.25Å; V112-F114 HydrophobicContact CG1-CZ 3.84Å; F114-L127 HydrophobicContact CB-CB 4.38Å; F114-L127 HydrophobicContact CB-CD1 4.44Å; F114-L127 HydrophobicContact CD1-CB 3.51Å; F114-L127 HydrophobicContact CD1-CD1 4.27Å; F114-L127 HydrophobicContact CD1-CG 4.49Å; F114-L127 HydrophobicContact CD2-CD1 4.33Å; F114-L127 HydrophobicContact CE1-CB 3.99Å; F114-L127 HydrophobicContact CG-CB 4.05Å; F114-L127 HydrophobicContact CG-CD1 4.08Å; F114-S128 CarbonylContact C-O 3.55Å; F114-S128 WeakPolarHBondContact CA-O 3.2Å; F114-Y129 HydrophobicContact CD1-CD1 4.32Å; F114-Y129 HydrophobicContact CE1-CD1 4.01Å; F114-Y129 HydrophobicContact CE1-CG 4.46Å; F114-V138 HydrophobicContact CD1-CG2 4.48Å; F114-V138 HydrophobicContact CE1-CG2 3.48Å; F114-V138 VanDerWaalsContact CE1-CG2 3.48Å; F114-V138 HydrophobicContact CZ-CG2 3.8Å; F114-H156 HydrophobicContact CD2-CB 3.96Å; F114-H156 HydrophobicContact CE2-CB 3.7Å; F114-H156 AromaticContact CE2-ND1 3.67Å; F114-H156 AromaticContact CZ-ND1 3.66Å; F114-P157 WeakPolarHBondContact CZ-O 3.36Å; F114-A158 HydrophobicContact CE2-CB 4.43Å; F114-A158 HydrophobicContact CZ-CB 4.04Å; F114-L167 PolarHBondContact N-O 2.92Å; F114-V168 HydrophobicContact CD2-CG2 4.17Å; F114-R169 WeakPolarHBondContact O-CG 3.43Å; F114-R169 PolarHBondContact O-N 3.1Å; F114-L172 HydrophobicContact CB-CD2 4.26Å
115	T	97.7	Very high	92.5	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.043	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-38.4	-172.5	56.1	0	0	0	0	112.2	Q50 V113 S128 R169	Q50-T115 WeakPolarHBondContact O-CG2 3.34Å; V113-T115 PolarHBondContact O-N 3.46Å; T115-S128 PolarHBondContact N-O 3.11Å; T115-S128 PolarHBondContact OG1-O 3.42Å; T115-R169 PolarHBondContact O-NE 2.82Å; T115-R169 PolarHBondContact O-NH2 2.65Å
116	H	97.3	Very high	92.5	Very high	93 Å²	93	61 Å²	61	43%	0.431	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.4	-175.3	-56	84.7	0	0	0	110.3	L118 S128 R169	H116-L118 HydrophobicContact CB-CD2 4.34Å; H116-S128 PolarHBondContact N-O 3.31Å; H116-S128 PolarHBondContact O-N 3.28Å; H116-R169 PolarHBondContact CD2-NH2 2.88Å; H116-R169 PolarHBondContact CE1-NH2 3.4Å; H116-R169 PolarHBondContact NE2-NH2 2.97Å
117	L	96.8	Very high	92.5	Very high	39 Å²	39	57.8 Å²	57.8	20%	0.204	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	117.2	163.3	-176.5	71.9	0	0	0	108.4	T119 P125 L127 F140 L172 W195	L117-T119 HydrophobicContact CD2-CG2 3.97Å; L117-T119 HydrophobicContact CG-CG2 4.07Å; L117-P125 HydrophobicContact CD1-CB 4.18Å; L117-L127 HydrophobicContact CB-CD2 4.15Å; L117-L127 HydrophobicContact CD1-CD2 3.67Å; L117-L127 HydrophobicContact CD1-CG 4.17Å; L117-F140 HydrophobicContact CD1-CB 3.93Å; L117-F140 HydrophobicContact CD1-CD1 3.95Å; L117-F140 HydrophobicContact CD1-CD2 4.16Å; L117-F140 HydrophobicContact CD1-CE1 4.5Å; L117-F140 HydrophobicContact CD1-CG 3.74Å; L117-L172 HydrophobicContact CB-CD1 4.08Å; L117-W195 HydrophobicContact CD2-CH2 3.47Å; L117-W195 VanDerWaalsContact CD2-CH2 3.47Å; L117-W195 HydrophobicContact CD2-CZ2 4.01Å
118	L	95.5	Very high	92.7	Very high	38 Å²	38	56.5 Å²	56.5	20%	0.199	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	110.7	175.8	-53.1	-177.5	0	0	0	108.4	H116 P125 R126 E134 A137	H116-L118 HydrophobicContact CB-CD2 4.34Å; L118-P125 WeakPolarHBondContact O-CA 3.46Å; L118-R126 HydrophobicContact CB-CB 4.46Å; L118-R126 WeakPolarHBondContact CB-O 3.4Å; L118-R126 PolarHBondContact N-O 3.37Å; L118-R126 PolarHBondContact O-N 2.87Å; L118-E134 VanDerWaalsContact CD1-CD 3.49Å; L118-E134 HydrophobicContact CD1-CG 4.09Å; L118-E134 WeakPolarHBondContact CD1-OE1 3.39Å; L118-A137 HydrophobicContact CD1-CB 4.07Å
119	T	89.6	Confident	92.8	Very high	105 Å²	105	53.5 Å²	53.5	64%	0.644	27%	0.271	S	S	*	.			trans	-114.6	102.1	172.1	54.2	0	0	0	0	107.7	L117 P125	L117-T119 HydrophobicContact CD2-CG2 3.97Å; L117-T119 HydrophobicContact CG-CG2 4.07Å; T119-P125 HydrophobicContact CG2-CB 4.42Å
120	A	81.6	Confident	92.9	Very high	43 Å²	43	51.7 Å²	51.7	36%	0.355	26%	0.262	S	S	.	.			trans	-106.8	144.6	171.9	0	0	0	0	0	109.1	H122 R123	A120-H122 PolarHBondContact O-N 3.06Å; A120-R123 HydrophobicContact CB-CB 4.38Å; A120-R123 PolarHBondContact O-N 3.47Å; A120-R123 VanDerWaalsContact O-N 3.12Å
121	D	70.3	Confident	92.8	Very high	149 Å²	149	52.9 Å²	52.9	80%	0.797	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	131.4	176.5	-66.4	-32.5	0	0	0	109.9	R123	D121-R123 VanDerWaalsContact C-N 3.26Å; D121-R123 PolarHBondContact O-N 3Å
122	H	76.8	Confident	92.7	Very high	201 Å²	201	53.2 Å²	53.2	93%	0.931	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	10.7	-179.5	-47.5	-75.9	0	0	0	117	A120	A120-H122 PolarHBondContact O-N 3.06Å
123	R	84.5	Confident	92.5	Very high	173 Å²	173	54.6 Å²	54.6	65%	0.653	30%	0.299	S	S	*	.	S	Bend	trans	-114.5	145.6	170.7	-66.5	-171.6	-176.3	179.1	1.9	111.6	A120 D121	A120-R123 HydrophobicContact CB-CB 4.38Å; A120-R123 PolarHBondContact O-N 3.47Å; A120-R123 VanDerWaalsContact O-N 3.12Å; D121-R123 VanDerWaalsContact C-N 3.26Å; D121-R123 PolarHBondContact O-N 3Å
124	P	89.6	Confident	92.3	Very high	103 Å²	103	58.8 Å²	58.8	67%	0.669	32%	0.319	S	S	*	.			trans	-60.1	142.6	171.5	26.5	-33.5	0	0	0	109.5
125	P	94.9	Very high	92.2	Very high	18 Å²	18	62 Å²	62	12%	0.117	35%	0.345	C	S	.	.			trans	-60.9	142.6	-180	24.9	-33.3	0	0	0	110.9	L117 L118 T119 F140 W195	L117-P125 HydrophobicContact CD1-CB 4.18Å; L118-P125 WeakPolarHBondContact O-CA 3.46Å; T119-P125 HydrophobicContact CG2-CB 4.42Å; P125-F140 HydrophobicContact CB-CB 4.07Å; P125-F140 HydrophobicContact CB-CD1 4.31Å; P125-F140 HydrophobicContact CG-CB 4.2Å; P125-F140 HydrophobicContact CG-CD1 4.18Å; P125-F140 VanDerWaalsContact O-CB 3.32Å; P125-F140 WeakPolarHBondContact O-CB 3.45Å; P125-F140 PolarHBondContact O-N 2.97Å; P125-W195 HydrophobicContact CB-CZ2 4.42Å; P125-W195 HydrophobicContact CG-CZ2 4.32Å
126	R	97.1	Very high	92.2	Very high	76 Å²	76	61.6 Å²	61.6	29%	0.287	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.2	-179.9	-62.1	176.4	72	-154.2	5.8	110.6	L118 E134 A137 V138	L118-R126 HydrophobicContact CB-CB 4.46Å; L118-R126 WeakPolarHBondContact CB-O 3.4Å; L118-R126 PolarHBondContact N-O 3.37Å; L118-R126 PolarHBondContact O-N 2.87Å; R126-E134 PolarHBondContact NH1-O 3.07Å; R126-E134 IonicContact NH1-OE2 2.8Å; R126-E134 PolarHBondContact NH1-OE2 3.05Å; R126-A137 HydrophobicContact CB-CB 4.13Å; R126-A137 PolarHBondContact NH2-O 2.78Å; R126-V138 CarbonylContact C-O 3.55Å; R126-V138 WeakPolarHBondContact CA-O 3.18Å; R126-V138 VanDerWaalsContact CB-O 3.31Å; R126-V138 WeakPolarHBondContact CB-O 3.29Å
127	L	98	Very high	92.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.6	172.3	-74.5	176.6	0	0	0	110.3	F114 L117 A137 V138 F140 H156 L172	F114-L127 HydrophobicContact CB-CB 4.38Å; F114-L127 HydrophobicContact CB-CD1 4.44Å; F114-L127 HydrophobicContact CD1-CB 3.51Å; F114-L127 HydrophobicContact CD1-CD1 4.27Å; F114-L127 HydrophobicContact CD1-CG 4.49Å; F114-L127 HydrophobicContact CD2-CD1 4.33Å; F114-L127 HydrophobicContact CE1-CB 3.99Å; F114-L127 HydrophobicContact CG-CB 4.05Å; F114-L127 HydrophobicContact CG-CD1 4.08Å; L117-L127 HydrophobicContact CB-CD2 4.15Å; L117-L127 HydrophobicContact CD1-CD2 3.67Å; L117-L127 HydrophobicContact CD1-CG 4.17Å; L127-A137 CarbonylContact O-C 3.43Å; L127-A137 WeakPolarHBondContact O-CA 3.47Å; L127-A137 WeakPolarHBondContact O-CB 3.17Å; L127-V138 HydrophobicContact CB-CG2 4.2Å; L127-V138 PolarHBondContact N-O 3.16Å; L127-V138 PolarHBondContact O-N 2.79Å; L127-F140 HydrophobicContact CD1-CD2 3.54Å; L127-F140 HydrophobicContact CD1-CE2 4.03Å; L127-F140 HydrophobicContact CD2-CD2 4.17Å; L127-F140 HydrophobicContact CG-CB 4.33Å; L127-F140 HydrophobicContact CG-CD2 3.64Å; L127-F140 HydrophobicContact CG-CE2 4.39Å; L127-F140 HydrophobicContact CG-CG 4.34Å; L127-H156 HydrophobicContact CD1-CB 4.02Å; L127-H156 VanDerWaalsContact CD1-CG 3.43Å; L127-H156 WeakPolarHBondContact CD1-ND1 3.44Å; L127-L172 HydrophobicContact CD2-CD2 3.78Å
128	S	98	Very high	92.2	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.014	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	143.8	172.3	-174.3	0	0	0	0	111.2	F114 T115 H116 G133 L136	F114-S128 CarbonylContact C-O 3.55Å; F114-S128 WeakPolarHBondContact CA-O 3.2Å; T115-S128 PolarHBondContact N-O 3.11Å; T115-S128 PolarHBondContact OG1-O 3.42Å; H116-S128 PolarHBondContact N-O 3.31Å; H116-S128 PolarHBondContact O-N 3.28Å; S128-G133 VanDerWaalsContact OG-C 3.3Å; S128-G133 WeakPolarHBondContact OG-CA 3.49Å; S128-G133 PolarHBondContact OG-N 3.45Å; S128-G133 PolarHBondContact OG-O 3.01Å; S128-L136 CarbonylContact C-O 3.57Å; S128-L136 VanDerWaalsContact CA-O 3.28Å; S128-L136 WeakPolarHBondContact CA-O 3.43Å; S128-L136 PolarHBondContact OG-O 2.83Å
129	Y	98.3	Very high	92.3	Very high	12 Å²	12	59.3 Å²	59.3	5%	0.047	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153.9	-178.5	59.9	-87.8	0	0	0	113.3	F77 V112 V113 F114 G131 G132 L136 V138	F77-Y129 HydrophobicContact CB-CE2 4.11Å; V112-Y129 HydrophobicContact CG1-CD1 4.29Å; V112-Y129 HydrophobicContact CG1-CD2 3.94Å; V112-Y129 HydrophobicContact CG1-CG 3.77Å; V113-Y129 WeakPolarHBondContact O-CA 3.35Å; V113-Y129 VanDerWaalsContact O-CB 3.23Å; V113-Y129 WeakPolarHBondContact O-CB 3.23Å; F114-Y129 HydrophobicContact CD1-CD1 4.32Å; F114-Y129 HydrophobicContact CE1-CD1 4.01Å; F114-Y129 HydrophobicContact CE1-CG 4.46Å; Y129-G131 PolarHBondContact O-N 2.9Å; Y129-G132 PolarHBondContact O-N 2.97Å; Y129-G132 VanDerWaalsContact O-N 3.07Å; Y129-L136 HydrophobicContact CD1-CB 4.12Å; Y129-L136 WeakPolarHBondContact CD1-O 3.21Å; Y129-L136 HydrophobicContact CD2-CB 4.03Å; Y129-L136 HydrophobicContact CD2-CD1 4.17Å; Y129-L136 HydrophobicContact CE1-CB 3.81Å; Y129-L136 WeakPolarHBondContact CE1-O 3.29Å; Y129-L136 HydrophobicContact CE2-CB 3.72Å; Y129-L136 HydrophobicContact CE2-CD1 3.88Å; Y129-L136 HydrophobicContact CE2-CD2 3.92Å; Y129-L136 HydrophobicContact CE2-CG 4.06Å; Y129-L136 HydrophobicContact CG-CB 4.22Å; Y129-L136 PolarHBondContact N-O 2.9Å; Y129-L136 WeakPolarHBondContact OH-CD2 3.34Å; Y129-V138 HydrophobicContact CE1-CG1 4.2Å
130	C	96.8	Very high	92.7	Very high	1 Å²	1	55 Å²	55	1%	0.007	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.3	39.2	170.5	-51.3	0	0	0	0	115.5	F77 V113 G132	F77-C130 HydrophobicContact CD1-CB 4.1Å; F77-C130 HydrophobicContact CD2-CB 3.53Å; F77-C130 HydrophobicContact CE1-CB 3.89Å; F77-C130 HydrophobicContact CE2-CB 3.32Å; F77-C130 HydrophobicContact CG-CB 3.94Å; F77-C130 HydrophobicContact CZ-CB 3.5Å; V113-C130 PolarHBondContact N-SG 3.47Å; V113-C130 VanDerWaalsContact N-SG 3.4Å; V113-C130 PolarHBondContact O-N 3.2Å; C130-G132 VanDerWaalsContact C-N 3.31Å; C130-G132 PolarHBondContact O-N 2.81Å
131	G	94.2	Very high	93.4	Very high	46 Å²	46	56.6 Å²	56.6	47%	0.474	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	7.1	175.7	0	0	0	0	0	116.4	Y129	Y129-G131 PolarHBondContact O-N 2.9Å
132	G	93.7	Very high	94.7	Very high	8 Å²	8	50.2 Å²	50.2	8%	0.082	28%	0.28	C	S	.	.			trans	-89.9	5.2	-177	0	0	0	0	0	116.2	Y129 C130 E134 A135 L136	Y129-G132 PolarHBondContact O-N 2.97Å; Y129-G132 VanDerWaalsContact O-N 3.07Å; C130-G132 VanDerWaalsContact C-N 3.31Å; C130-G132 PolarHBondContact O-N 2.81Å; G132-E134 PolarHBondContact O-N 3.32Å; G132-A135 WeakPolarHBondContact O-CB 3.15Å; G132-A135 PolarHBondContact O-N 2.98Å; G132-L136 PolarHBondContact O-N 3.38Å
133	G	94.9	Very high	95.7	Very high	31 Å²	31	41.8 Å²	41.8	32%	0.32	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	55.2	-137.2	175.7	0	0	0	0	0	113.1	S128 A135 L136	S128-G133 VanDerWaalsContact OG-C 3.3Å; S128-G133 WeakPolarHBondContact OG-CA 3.49Å; S128-G133 PolarHBondContact OG-N 3.45Å; S128-G133 PolarHBondContact OG-O 3.01Å; G133-A135 PolarHBondContact O-N 3.41Å; G133-L136 CarbonylContact O-C 3.57Å; G133-L136 PolarHBondContact O-N 2.83Å
134	E	94.6	Very high	96.3	Very high	89 Å²	89	36.8 Å²	36.8	42%	0.416	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-62.6	-26.8	178.1	-73.6	-69.5	169.1	0	0	114.2	L118 R126 G132	L118-E134 VanDerWaalsContact CD1-CD 3.49Å; L118-E134 HydrophobicContact CD1-CG 4.09Å; L118-E134 WeakPolarHBondContact CD1-OE1 3.39Å; R126-E134 PolarHBondContact NH1-O 3.07Å; R126-E134 IonicContact NH1-OE2 2.8Å; R126-E134 PolarHBondContact NH1-OE2 3.05Å; G132-E134 PolarHBondContact O-N 3.32Å
135	A	96.4	Very high	96.7	Very high	67 Å²	67	31.9 Å²	31.9	55%	0.554	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-75.4	-30	-179.2	0	0	0	0	0	112.1	V74 G132 G133	V74-A135 HydrophobicContact CG1-CB 3.99Å; V74-A135 HydrophobicContact CG2-CB 3.75Å; G132-A135 WeakPolarHBondContact O-CB 3.15Å; G132-A135 PolarHBondContact O-N 2.98Å; G133-A135 PolarHBondContact O-N 3.41Å
136	L	96.9	Very high	96.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	-113.7	75.4	172.4	-64.9	-174	0	0	0	109.8	V74 F77 S78 S128 Y129 G132 G133	V74-L136 HydrophobicContact CG2-CG 4.18Å; F77-L136 HydrophobicContact CB-CD1 3.59Å; F77-L136 HydrophobicContact CB-CD2 4.28Å; F77-L136 HydrophobicContact CD2-CD1 4.12Å; F77-L136 HydrophobicContact CG-CD1 4.22Å; S78-L136 WeakPolarHBondContact OG-CD2 3.32Å; S128-L136 CarbonylContact C-O 3.57Å; S128-L136 VanDerWaalsContact CA-O 3.28Å; S128-L136 WeakPolarHBondContact CA-O 3.43Å; S128-L136 PolarHBondContact OG-O 2.83Å; Y129-L136 HydrophobicContact CD1-CB 4.12Å; Y129-L136 WeakPolarHBondContact CD1-O 3.21Å; Y129-L136 HydrophobicContact CD2-CB 4.03Å; Y129-L136 HydrophobicContact CD2-CD1 4.17Å; Y129-L136 HydrophobicContact CE1-CB 3.81Å; Y129-L136 WeakPolarHBondContact CE1-O 3.29Å; Y129-L136 HydrophobicContact CE2-CB 3.72Å; Y129-L136 HydrophobicContact CE2-CD1 3.88Å; Y129-L136 HydrophobicContact CE2-CD2 3.92Å; Y129-L136 HydrophobicContact CE2-CG 4.06Å; Y129-L136 HydrophobicContact CG-CB 4.22Å; Y129-L136 PolarHBondContact N-O 2.9Å; Y129-L136 WeakPolarHBondContact OH-CD2 3.34Å; G132-L136 PolarHBondContact O-N 3.38Å; G133-L136 CarbonylContact O-C 3.57Å; G133-L136 PolarHBondContact O-N 2.83Å
137	A	97.4	Very high	96.7	Very high	14 Å²	14	28.3 Å²	28.3	12%	0.116	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	145.2	177.5	0	0	0	0	0	113.2	L118 R126 L127	L118-A137 HydrophobicContact CD1-CB 4.07Å; R126-A137 HydrophobicContact CB-CB 4.13Å; R126-A137 PolarHBondContact NH2-O 2.78Å; L127-A137 CarbonylContact O-C 3.43Å; L127-A137 WeakPolarHBondContact O-CA 3.47Å; L127-A137 WeakPolarHBondContact O-CB 3.17Å
138	V	97.5	Very high	96.5	Very high	19 Å²	19	31 Å²	31	12%	0.115	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	154.9	176.4	-58.3	0	0	0	0	110.4	F114 R126 L127 Y129 F140 P159	F114-V138 HydrophobicContact CD1-CG2 4.48Å; F114-V138 HydrophobicContact CE1-CG2 3.48Å; F114-V138 VanDerWaalsContact CE1-CG2 3.48Å; F114-V138 HydrophobicContact CZ-CG2 3.8Å; R126-V138 CarbonylContact C-O 3.55Å; R126-V138 WeakPolarHBondContact CA-O 3.18Å; R126-V138 VanDerWaalsContact CB-O 3.31Å; R126-V138 WeakPolarHBondContact CB-O 3.29Å; L127-V138 HydrophobicContact CB-CG2 4.2Å; L127-V138 PolarHBondContact N-O 3.16Å; L127-V138 PolarHBondContact O-N 2.79Å; Y129-V138 HydrophobicContact CE1-CG1 4.2Å; V138-F140 PolarHBondContact O-N 3.33Å; V138-P159 HydrophobicContact CG1-CG 4.13Å
139	P	97.4	Very high	96	Very high	88 Å²	88	33.9 Å²	33.9	57%	0.571	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-53.8	136.2	171.8	-24.5	35.1	0	0	0	111.4	E141 H156	P139-E141 PolarHBondContact O-N 3.17Å; P139-H156 PolarHBondContact O-CE1 3.17Å
140	F	97.6	Very high	95.6	Very high	16 Å²	16	37.9 Å²	37.9	7%	0.07	26%	0.255	C	S	.	.			trans	-78.9	123.7	174.1	-179.5	-125.6	0	0	0	110.2	L117 P125 L127 V138 P142 L145 L176 W195	L117-F140 HydrophobicContact CD1-CB 3.93Å; L117-F140 HydrophobicContact CD1-CD1 3.95Å; L117-F140 HydrophobicContact CD1-CD2 4.16Å; L117-F140 HydrophobicContact CD1-CE1 4.5Å; L117-F140 HydrophobicContact CD1-CG 3.74Å; P125-F140 HydrophobicContact CB-CB 4.07Å; P125-F140 HydrophobicContact CB-CD1 4.31Å; P125-F140 HydrophobicContact CG-CB 4.2Å; P125-F140 HydrophobicContact CG-CD1 4.18Å; P125-F140 VanDerWaalsContact O-CB 3.32Å; P125-F140 WeakPolarHBondContact O-CB 3.45Å; P125-F140 PolarHBondContact O-N 2.97Å; L127-F140 HydrophobicContact CD1-CD2 3.54Å; L127-F140 HydrophobicContact CD1-CE2 4.03Å; L127-F140 HydrophobicContact CD2-CD2 4.17Å; L127-F140 HydrophobicContact CG-CB 4.33Å; L127-F140 HydrophobicContact CG-CD2 3.64Å; L127-F140 HydrophobicContact CG-CE2 4.39Å; L127-F140 HydrophobicContact CG-CG 4.34Å; V138-F140 PolarHBondContact O-N 3.33Å; F140-P142 HydrophobicContact CE1-CB 3.81Å; F140-P142 HydrophobicContact CE1-CG 4.28Å; F140-P142 HydrophobicContact CZ-CB 3.96Å; F140-P142 WeakPolarHBondContact O-CD 3.46Å; F140-L145 HydrophobicContact CE2-CD1 4.05Å; F140-L145 HydrophobicContact CE2-CD2 4.18Å; F140-L145 HydrophobicContact CE2-CG 4.22Å; F140-L145 HydrophobicContact CZ-CD1 3.9Å; F140-L176 HydrophobicContact CE2-CD1 4.43Å; F140-L176 HydrophobicContact CZ-CD2 3.94Å; F140-W195 HydrophobicContact CD1-CD2 4.4Å; F140-W195 AromaticContact CD1-CE2 3.76Å; F140-W195 HydrophobicContact CD1-CH2 4.15Å; F140-W195 AromaticContact CD1-CZ2 3.63Å; F140-W195 HydrophobicContact CD1-CZ2 3.63Å; F140-W195 AromaticContact CE1-CD2 3.69Å; F140-W195 HydrophobicContact CE1-CD2 3.69Å; F140-W195 AromaticContact CE1-CE2 3.48Å; F140-W195 VanDerWaalsContact CE1-CE2 3.48Å; F140-W195 AromaticContact CE1-CE3 3.8Å; F140-W195 HydrophobicContact CE1-CE3 3.8Å; F140-W195 HydrophobicContact CE1-CG 4.49Å; F140-W195 AromaticContact CE1-CH2 3.58Å; F140-W195 HydrophobicContact CE1-CH2 3.58Å; F140-W195 AromaticContact CE1-CZ2 3.43Å; F140-W195 HydrophobicContact CE1-CZ2 3.43Å; F140-W195 VanDerWaalsContact CE1-CZ2 3.43Å; F140-W195 AromaticContact CE1-CZ3 3.75Å; F140-W195 HydrophobicContact CE1-CZ3 3.75Å; F140-W195 HydrophobicContact CZ-CE3 4.47Å; F140-W195 HydrophobicContact CZ-CH2 4.43Å; F140-W195 HydrophobicContact CZ-CZ3 4.34Å
141	E	97.5	Very high	95.3	Very high	76 Å²	76	41.1 Å²	41.1	36%	0.355	27%	0.272	S	S	.	.			trans	-119.5	85.3	-177.4	-64.6	-172	-96.7	0	0	108.8	P139 A143 R144 H156	P139-E141 PolarHBondContact O-N 3.17Å; E141-A143 VanDerWaalsContact C-N 3.32Å; E141-A143 PolarHBondContact O-N 2.81Å; E141-R144 HydrophobicContact CB-CB 4.14Å; E141-R144 HydrophobicContact CB-CG 4.29Å; E141-R144 PolarHBondContact O-N 3.18Å; E141-R144 IonicContact OE1-NH1 3.78Å; E141-R144 PolarHBondContact OE1-NH1 3.33Å; E141-R144 WeakPolarHBondContact OE2-CD 3.48Å; E141-R144 IonicContact OE2-NH1 3.93Å; E141-H156 PolarHBondContact N-NE2 3.41Å
142	P	96.9	Very high	95.1	Very high	14 Å²	14	42.2 Å²	42.2	9%	0.091	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-59.6	-40.4	-171.4	21	-33.3	0	0	0	112.7	F140 R144 L145 V193 W195 L200	F140-P142 HydrophobicContact CE1-CB 3.81Å; F140-P142 HydrophobicContact CE1-CG 4.28Å; F140-P142 HydrophobicContact CZ-CB 3.96Å; F140-P142 WeakPolarHBondContact O-CD 3.46Å; P142-R144 PolarHBondContact O-N 3.49Å; P142-R144 VanDerWaalsContact O-N 3.13Å; P142-L145 WeakPolarHBondContact O-CB 3.42Å; P142-L145 WeakPolarHBondContact O-CG 3.44Å; P142-L145 PolarHBondContact O-N 2.89Å; P142-L145 VanDerWaalsContact O-N 3.13Å; P142-V193 HydrophobicContact CB-CG1 3.91Å; P142-V193 HydrophobicContact CB-CG2 4.39Å; P142-V193 WeakPolarHBondContact O-CG1 3.29Å; P142-W195 HydrophobicContact CB-CB 3.97Å; P142-W195 HydrophobicContact CB-CD2 4.33Å; P142-W195 HydrophobicContact CB-CG 3.95Å; P142-W195 HydrophobicContact CG-CB 3.98Å; P142-W195 HydrophobicContact CG-CD2 4.49Å; P142-W195 HydrophobicContact CG-CG 3.8Å; P142-L200 HydrophobicContact CB-CD1 4.3Å; P142-L200 HydrophobicContact CG-CD1 3.69Å
143	A	97.6	Very high	95.2	Very high	25 Å²	25	45.2 Å²	45.2	21%	0.207	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-65.3	-14.7	179.5	0	0	0	0	0	114.1	E141 L200 L202 T203	E141-A143 VanDerWaalsContact C-N 3.32Å; E141-A143 PolarHBondContact O-N 2.81Å; A143-L200 HydrophobicContact CB-CB 4.1Å; A143-L200 HydrophobicContact CB-CD1 4.41Å; A143-L202 WeakPolarHBondContact O-CA 3.19Å; A143-T203 HydrophobicContact CB-CG2 4.41Å; A143-T203 PolarHBondContact O-N 2.91Å; A143-T203 PolarHBondContact O-OG1 3.15Å
144	R	97.9	Very high	95.4	Very high	67 Å²	67	44.2 Å²	44.2	25%	0.253	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-104.5	8.1	179.1	-59.7	-176.4	71.3	-156.9	2.8	112.8	E141 P142 L146 P157 D205 L206	E141-R144 HydrophobicContact CB-CB 4.14Å; E141-R144 HydrophobicContact CB-CG 4.29Å; E141-R144 PolarHBondContact O-N 3.18Å; E141-R144 IonicContact OE1-NH1 3.78Å; E141-R144 PolarHBondContact OE1-NH1 3.33Å; E141-R144 WeakPolarHBondContact OE2-CD 3.48Å; E141-R144 IonicContact OE2-NH1 3.93Å; P142-R144 PolarHBondContact O-N 3.49Å; P142-R144 VanDerWaalsContact O-N 3.13Å; R144-L146 PolarHBondContact O-N 2.78Å; R144-P157 HydrophobicContact CB-CG 3.68Å; R144-P157 HydrophobicContact CG-CG 4.46Å; R144-P157 VanDerWaalsContact NH1-CG 3.25Å; R144-D205 IonicContact CZ-OD2 3.45Å; R144-D205 IonicContact NE-OD1 2.66Å; R144-D205 IonicContact NE-OD2 2.79Å; R144-D205 PolarHBondContact NE-OD2 3.14Å; R144-D205 IonicContact NH2-OD2 3.37Å; R144-D205 PolarHBondContact NH2-OD2 3.37Å; R144-L206 WeakPolarHBondContact O-CD1 3.44Å
145	L	97.9	Very high	95.5	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	26%	0.261	C	S	.	.			trans	-61.2	129.5	165.8	-75.4	173.4	0	0	0	109.4	F140 P142 L154 Y155 H156 V168 L176 F180 L202	F140-L145 HydrophobicContact CE2-CD1 4.05Å; F140-L145 HydrophobicContact CE2-CD2 4.18Å; F140-L145 HydrophobicContact CE2-CG 4.22Å; F140-L145 HydrophobicContact CZ-CD1 3.9Å; P142-L145 WeakPolarHBondContact O-CB 3.42Å; P142-L145 WeakPolarHBondContact O-CG 3.44Å; P142-L145 PolarHBondContact O-N 2.89Å; P142-L145 VanDerWaalsContact O-N 3.13Å; L145-L154 HydrophobicContact CB-CD1 4.24Å; L145-L154 HydrophobicContact CD2-CD1 4.32Å; L145-L154 HydrophobicContact CD2-CD2 4.16Å; L145-L154 HydrophobicContact CD2-CG 4.22Å; L145-Y155 WeakPolarHBondContact CA-O 3.3Å; L145-H156 HydrophobicContact CD2-CB 4.1Å; L145-V168 HydrophobicContact CD2-CG2 4.43Å; L145-L176 HydrophobicContact CD1-CD1 4.36Å; L145-L176 HydrophobicContact CD2-CD1 4.4Å; L145-F180 HydrophobicContact CB-CE1 4.21Å; L145-F180 HydrophobicContact CB-CZ 4.17Å; L145-F180 HydrophobicContact CD1-CE1 4.07Å; L145-F180 HydrophobicContact CD1-CZ 3.89Å; L145-L202 HydrophobicContact CB-CD2 4.32Å
146	L	97	Very high	95.6	Very high	4 Å²	4	37 Å²	37	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	101.5	-179.3	177.6	66.4	0	0	0	110	R144 Y155 M204 L206 A207 L210	R144-L146 PolarHBondContact O-N 2.78Å; L146-Y155 PolarHBondContact N-O 3.36Å; L146-Y155 PolarHBondContact O-N 3.1Å; L146-M204 HydrophobicContact CD1-CB 4.37Å; L146-M204 HydrophobicContact CD1-CE 3.46Å; L146-M204 VanDerWaalsContact CD1-CE 3.46Å; L146-M204 HydrophobicContact CD1-SD 3.52Å; L146-M204 VanDerWaalsContact CD1-SD 3.52Å; L146-L206 HydrophobicContact CB-CB 4.26Å; L146-L206 HydrophobicContact CB-CD1 4.3Å; L146-L206 HydrophobicContact CD2-CB 3.62Å; L146-A207 HydrophobicContact CD2-CB 4.22Å; L146-L210 HydrophobicContact CD2-CD1 3.44Å; L146-L210 VanDerWaalsContact CD2-CD1 3.44Å; L146-L210 HydrophobicContact CD2-CG 4.11Å; L146-L210 HydrophobicContact CG-CD1 4.33Å
147	P	94.9	Very high	95.7	Very high	15 Å²	15	37.4 Å²	37.4	10%	0.097	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.7	168.3	29.3	-28.9	0	0	0	109.5	L154 L189 P190 L202	P147-L154 HydrophobicContact CB-CD1 4.12Å; P147-L189 HydrophobicContact CB-CD2 3.98Å; P147-L189 HydrophobicContact CG-CD2 4.18Å; P147-P190 HydrophobicContact CB-CG 4.36Å; P147-P190 HydrophobicContact CG-CG 3.62Å; P147-L202 HydrophobicContact CG-CD1 4.18Å
148	L	92.4	Very high	95.7	Very high	55 Å²	55	37.3 Å²	37.3	29%	0.288	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	109.8	179.3	-174.2	65.9	0	0	0	110.4	A150 N151 G152 R153 Y155 L210	L148-A150 HydrophobicContact CG-CB 4.24Å; L148-A150 PolarHBondContact O-N 2.94Å; L148-N151 PolarHBondContact O-N 3.45Å; L148-N151 PolarHBondContact O-OD1 3.37Å; L148-G152 WeakPolarHBondContact O-CA 3.36Å; L148-G152 PolarHBondContact O-N 2.66Å; L148-R153 PolarHBondContact N-O 3.17Å; L148-Y155 HydrophobicContact CB-CD2 4.18Å; L148-Y155 HydrophobicContact CB-CE2 3.8Å; L148-Y155 HydrophobicContact CD2-CE2 4.05Å; L148-L210 HydrophobicContact CB-CD1 4.41Å; L148-L210 HydrophobicContact CD1-CD1 4.47Å; L148-L210 HydrophobicContact CD2-CD1 3.98Å
149	A	88.4	Confident	95.6	Very high	64 Å²	64	37.9 Å²	37.9	53%	0.529	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-33.7	-178.1	0	0	0	0	0	113.1	N151 L189	A149-N151 PolarHBondContact O-N 2.79Å; A149-L189 HydrophobicContact CB-CD1 4.01Å; A149-L189 HydrophobicContact CB-CD2 3.86Å; A149-L189 HydrophobicContact CB-CG 3.99Å
150	A	88.9	Confident	95.4	Very high	96 Å²	96	42 Å²	42	79%	0.793	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.2	-173.8	0	0	0	0	0	113.9	L148	L148-A150 HydrophobicContact CG-CB 4.24Å; L148-A150 PolarHBondContact O-N 2.94Å
151	N	90.5	Very high	95.1	Very high	68 Å²	68	46.9 Å²	46.9	36%	0.364	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	-0.3	-179.8	65.4	4.1	0	0	0	113.8	L148 A149 R153 Y155	L148-N151 PolarHBondContact O-N 3.45Å; L148-N151 PolarHBondContact O-OD1 3.37Å; A149-N151 PolarHBondContact O-N 2.79Å; N151-R153 HydrophobicContact CB-CG 4.37Å; N151-R153 PolarHBondContact O-N 2.98Å; N151-R153 WeakPolarHBondContact OD1-CB 3.32Å; N151-R153 PolarHBondContact OD1-N 3.38Å; N151-Y155 PolarHBondContact ND2-OH 3.48Å
152	G	91.3	Very high	94.9	Very high	70 Å²	70	43.4 Å²	43.4	72%	0.722	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	19.1	-178.6	0	0	0	0	0	114.1	L148	L148-G152 WeakPolarHBondContact O-CA 3.36Å; L148-G152 PolarHBondContact O-N 2.66Å
153	R	95.8	Very high	94.6	Very high	71 Å²	71	44.1 Å²	44.1	27%	0.268	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	157	-178.8	-63.2	-177	173.7	-164.7	-7.4	111.2	E108 D109 L148 N151 Y155 L167	E108-R153 IonicContact OE1-CZ 3.58Å; E108-R153 IonicContact OE1-NH1 3.87Å; E108-R153 IonicContact OE1-NH2 3.76Å; E108-R153 PolarHBondContact OE1-NH2 2.76Å; D109-R153 VanDerWaalsContact CG-NH1 3.34Å; D109-R153 WeakPolarHBondContact OD2-CD 3.49Å; D109-R153 IonicContact OD2-CZ 3.64Å; D109-R153 IonicContact OD2-NE 3.01Å; D109-R153 IonicContact OD2-NH1 3.03Å; D109-R153 PolarHBondContact OD2-NH1 2.97Å; L148-R153 PolarHBondContact N-O 3.17Å; N151-R153 HydrophobicContact CB-CG 4.37Å; N151-R153 PolarHBondContact O-N 2.98Å; N151-R153 WeakPolarHBondContact OD1-CB 3.32Å; N151-R153 PolarHBondContact OD1-N 3.38Å; R153-Y155 HydrophobicContact CB-CE2 3.74Å; R153-L167 HydrophobicContact CB-CD1 3.83Å; R153-L167 HydrophobicContact CG-CD1 4.17Å
154	L	97.8	Very high	94.5	Very high	9 Å²	9	43.5 Å²	43.5	5%	0.047	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.8	178.1	-178	65.7	0	0	0	109.4	L145 P147 V168 A173 L176 F180	L145-L154 HydrophobicContact CB-CD1 4.24Å; L145-L154 HydrophobicContact CD2-CD1 4.32Å; L145-L154 HydrophobicContact CD2-CD2 4.16Å; L145-L154 HydrophobicContact CD2-CG 4.22Å; P147-L154 HydrophobicContact CB-CD1 4.12Å; L154-V168 HydrophobicContact CB-CB 4.08Å; L154-V168 HydrophobicContact CB-CG2 4.5Å; L154-V168 HydrophobicContact CD2-CB 4.16Å; L154-V168 HydrophobicContact CD2-CG1 4.13Å; L154-V168 HydrophobicContact CD2-CG2 4.28Å; L154-V168 HydrophobicContact CG-CB 4.09Å; L154-V168 HydrophobicContact CG-CG2 4.06Å; L154-V168 WeakPolarHBondContact O-CB 3.35Å; L154-V168 PolarHBondContact O-N 2.82Å; L154-A173 HydrophobicContact CB-CB 3.94Å; L154-A173 HydrophobicContact CD2-CB 3.88Å; L154-L176 HydrophobicContact CD2-CB 4.48Å; L154-L176 HydrophobicContact CD2-CD1 4.2Å; L154-F180 HydrophobicContact CD1-CE2 4.17Å; L154-F180 HydrophobicContact CD1-CZ 3.76Å; L154-F180 HydrophobicContact CD2-CE2 4.14Å; L154-F180 HydrophobicContact CD2-CZ 4.12Å
155	Y	98.3	Very high	94.4	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.016	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	155.9	-177.4	-60.7	-88.9	0	0	0	111.6	D109 R110 L145 L146 L148 N151 R153 V165 G166 L167 L210	D109-Y155 PolarHBondContact OD1-OH 3.17Å; D109-Y155 PolarHBondContact OD2-OH 3.07Å; R110-Y155 HydrophobicContact CG-CD1 4.41Å; R110-Y155 HydrophobicContact CG-CE1 4.12Å; L145-Y155 WeakPolarHBondContact CA-O 3.3Å; L146-Y155 PolarHBondContact N-O 3.36Å; L146-Y155 PolarHBondContact O-N 3.1Å; L148-Y155 HydrophobicContact CB-CD2 4.18Å; L148-Y155 HydrophobicContact CB-CE2 3.8Å; L148-Y155 HydrophobicContact CD2-CE2 4.05Å; N151-Y155 PolarHBondContact ND2-OH 3.48Å; R153-Y155 HydrophobicContact CB-CE2 3.74Å; Y155-V165 HydrophobicContact CD1-CG2 4.13Å; Y155-V165 HydrophobicContact CG-CG2 4.28Å; Y155-G166 VanDerWaalsContact CA-O 3.28Å; Y155-G166 WeakPolarHBondContact CA-O 3.27Å; Y155-G166 WeakPolarHBondContact CD1-O 3.35Å; Y155-L167 HydrophobicContact CD1-CD1 4.46Å; Y155-L167 HydrophobicContact CE1-CB 4.4Å; Y155-L167 HydrophobicContact CE1-CD1 3.99Å; Y155-L210 HydrophobicContact CD1-CD1 4.47Å; Y155-L210 HydrophobicContact CD1-CD2 3.85Å; Y155-L210 HydrophobicContact CD2-CD1 3.53Å; Y155-L210 HydrophobicContact CD2-CD2 4.35Å; Y155-L210 HydrophobicContact CE1-CD2 3.99Å; Y155-L210 HydrophobicContact CE2-CD1 3.76Å; Y155-L210 HydrophobicContact CE2-CD2 4.48Å; Y155-L210 HydrophobicContact CG-CD1 3.92Å; Y155-L210 HydrophobicContact CG-CD2 4.04Å
156	H	98.5	Very high	94.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152.3	178.6	177.8	-88.5	0	0	0	110	F114 L127 P139 E141 L145 A158 G166 V168	F114-H156 HydrophobicContact CD2-CB 3.96Å; F114-H156 HydrophobicContact CE2-CB 3.7Å; F114-H156 AromaticContact CE2-ND1 3.67Å; F114-H156 AromaticContact CZ-ND1 3.66Å; L127-H156 HydrophobicContact CD1-CB 4.02Å; L127-H156 VanDerWaalsContact CD1-CG 3.43Å; L127-H156 WeakPolarHBondContact CD1-ND1 3.44Å; P139-H156 PolarHBondContact O-CE1 3.17Å; E141-H156 PolarHBondContact N-NE2 3.41Å; L145-H156 HydrophobicContact CD2-CB 4.1Å; H156-A158 PolarHBondContact O-N 2.81Å; H156-G166 PolarHBondContact N-O 3.33Å; H156-G166 PolarHBondContact O-N 3.17Å; H156-V168 HydrophobicContact CB-CG2 4.02Å
157	P	98.2	Very high	94.5	Very high	10 Å²	10	40.3 Å²	40.3	7%	0.065	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	130.6	176.4	-26.6	35.4	0	0	0	112.7	F114 R144 L206	F114-P157 WeakPolarHBondContact CZ-O 3.36Å; R144-P157 HydrophobicContact CB-CG 3.68Å; R144-P157 HydrophobicContact CG-CG 4.46Å; R144-P157 VanDerWaalsContact NH1-CG 3.25Å; P157-L206 HydrophobicContact CG-CD1 4Å; P157-L206 HydrophobicContact CG-CD2 4.16Å; P157-L206 HydrophobicContact CG-CG 4.44Å
158	A	97.3	Very high	94.7	Very high	12 Å²	12	39.8 Å²	39.8	10%	0.099	25%	0.245	C	C	.	.			trans	-120.9	168.9	178	0	0	0	0	0	110.3	V112 F114 H156 E160 G164 G166	V112-A158 HydrophobicContact CB-CB 4.04Å; V112-A158 HydrophobicContact CG1-CB 3.93Å; V112-A158 HydrophobicContact CG2-CB 4.24Å; F114-A158 HydrophobicContact CE2-CB 4.43Å; F114-A158 HydrophobicContact CZ-CB 4.04Å; H156-A158 PolarHBondContact O-N 2.81Å; A158-E160 PolarHBondContact O-N 3.06Å; A158-G164 PolarHBondContact N-O 3.21Å; A158-G164 CarbonylContact O-C 3.35Å; A158-G164 WeakPolarHBondContact O-CA 3.33Å; A158-G166 VanDerWaalsContact CB-N 3.34Å
159	P	96.1	Very high	94.9	Very high	30 Å²	30	39.4 Å²	39.4	20%	0.195	24%	0.24	C	C	.	.			trans	-53.6	132.8	176.2	-26.7	36.4	0	0	0	111.7	V138 R161 A162 G164	V138-P159 HydrophobicContact CG1-CG 4.13Å; P159-R161 HydrophobicContact CB-CG 4.04Å; P159-R161 PolarHBondContact O-N 3.08Å; P159-A162 CarbonylContact O-C 3.53Å; P159-A162 WeakPolarHBondContact O-CA 3.48Å; P159-A162 PolarHBondContact O-N 2.82Å; P159-G164 PolarHBondContact O-N 3.12Å; P159-G164 VanDerWaalsContact O-N 3.17Å
160	E	93.6	Very high	95.4	Very high	176 Å²	176	40.2 Å²	40.2	82%	0.822	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-56.5	-39.2	-177.6	-67.8	-174.6	167.4	0	0	112.5	A158 A162 G163	A158-E160 PolarHBondContact O-N 3.06Å; E160-A162 PolarHBondContact O-N 2.79Å; E160-A162 VanDerWaalsContact O-N 3.1Å; E160-G163 PolarHBondContact O-N 2.94Å
161	R	91.2	Very high	95.7	Very high	117 Å²	117	37.9 Å²	37.9	44%	0.442	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-57	-25.3	173.9	66.7	179.5	-179.2	-175.2	2.3	113.5	S78 L80 R81 P82 P159	S78-R161 PolarHBondContact O-NH1 2.85Å; S78-R161 PolarHBondContact O-NH2 2.9Å; L80-R161 WeakPolarHBondContact O-CG 3.24Å; R81-R161 VanDerWaalsContact CA-O 3.26Å; R81-R161 WeakPolarHBondContact CA-O 3.35Å; P82-R161 WeakPolarHBondContact CD-O 3.26Å; P159-R161 HydrophobicContact CB-CG 4.04Å; P159-R161 PolarHBondContact O-N 3.08Å
162	A	91.9	Very high	96.1	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.025	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-102.7	20.6	178.3	0	0	0	0	0	112.4	L80 P111 V112 P159 E160	L80-A162 HydrophobicContact CD2-CB 4.32Å; P111-A162 HydrophobicContact CG-CB 4.47Å; P111-A162 WeakPolarHBondContact CG-O 3.37Å; V112-A162 HydrophobicContact CG2-CB 3.53Å; P159-A162 CarbonylContact O-C 3.53Å; P159-A162 WeakPolarHBondContact O-CA 3.48Å; P159-A162 PolarHBondContact O-N 2.82Å; E160-A162 PolarHBondContact O-N 2.79Å; E160-A162 VanDerWaalsContact O-N 3.1Å
163	G	91.1	Very high	96.4	Very high	29 Å²	29	32.3 Å²	32.3	30%	0.299	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.3	6.8	177	0	0	0	0	0	115	E160 V165	E160-G163 PolarHBondContact O-N 2.94Å; G163-V165 PolarHBondContact O-N 2.86Å
164	G	95	Very high	96.4	Very high	13 Å²	13	36.7 Å²	36.7	13%	0.134	20%	0.2	C	C	.	.	S	Bend	trans	74.6	-14.7	168.2	0	0	0	0	0	116.4	A158 P159	A158-G164 PolarHBondContact N-O 3.21Å; A158-G164 CarbonylContact O-C 3.35Å; A158-G164 WeakPolarHBondContact O-CA 3.33Å; P159-G164 PolarHBondContact O-N 3.12Å; P159-G164 VanDerWaalsContact O-N 3.17Å
165	V	97.1	Very high	96.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	136.1	177.3	58.5	0	0	0	0	110.6	Y155 G163 L206 L209 L210	Y155-V165 HydrophobicContact CD1-CG2 4.13Å; Y155-V165 HydrophobicContact CG-CG2 4.28Å; G163-V165 PolarHBondContact O-N 2.86Å; V165-L206 HydrophobicContact CB-CD2 4.42Å; V165-L206 HydrophobicContact CG2-CB 4.46Å; V165-L206 HydrophobicContact CG2-CD1 3.93Å; V165-L209 HydrophobicContact CG1-CB 3.97Å; V165-L210 HydrophobicContact CG1-CD2 3.85Å; V165-L210 HydrophobicContact CG2-CD2 3.98Å
166	G	97.8	Very high	96.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	152.8	-178.5	0	0	0	0	0	111.5	V112 Y155 H156 A158	V112-G166 CarbonylContact O-C 3.49Å; V112-G166 WeakPolarHBondContact O-CA 3.49Å; Y155-G166 VanDerWaalsContact CA-O 3.28Å; Y155-G166 WeakPolarHBondContact CA-O 3.27Å; Y155-G166 WeakPolarHBondContact CD1-O 3.35Å; H156-G166 PolarHBondContact N-O 3.33Å; H156-G166 PolarHBondContact O-N 3.17Å; A158-G166 VanDerWaalsContact CB-N 3.34Å
167	L	98.6	Very high	96	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	136.6	173.3	175.3	66.4	0	0	0	109.2	H49 D109 R110 V112 V113 F114 R153 Y155	H49-L167 HydrophobicContact CB-CD2 3.85Å; D109-L167 HydrophobicContact CB-CD2 4.35Å; R110-L167 HydrophobicContact CB-CB 4.18Å; R110-L167 HydrophobicContact CG-CB 4.38Å; V112-L167 PolarHBondContact O-N 3.13Å; V113-L167 CarbonylContact C-O 3.42Å; V113-L167 VanDerWaalsContact CA-O 3.26Å; V113-L167 WeakPolarHBondContact CA-O 3.49Å; V113-L167 HydrophobicContact CG1-CD2 4.38Å; V113-L167 HydrophobicContact CG1-CG 4.47Å; V113-L167 HydrophobicContact CG2-CB 4.33Å; V113-L167 HydrophobicContact CG2-CD2 4.39Å; F114-L167 PolarHBondContact N-O 2.92Å; R153-L167 HydrophobicContact CB-CD1 3.83Å; R153-L167 HydrophobicContact CG-CD1 4.17Å; Y155-L167 HydrophobicContact CD1-CD1 4.46Å; Y155-L167 HydrophobicContact CE1-CB 4.4Å; Y155-L167 HydrophobicContact CE1-CD1 3.99Å
168	V	98.6	Very high	95.8	Very high	3 Å²	3	48 Å²	48	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	120.4	165.7	-176.4	0	0	0	0	107.6	F114 L145 L154 H156 L172 A173 L176	F114-V168 HydrophobicContact CD2-CG2 4.17Å; L145-V168 HydrophobicContact CD2-CG2 4.43Å; L154-V168 HydrophobicContact CB-CB 4.08Å; L154-V168 HydrophobicContact CB-CG2 4.5Å; L154-V168 HydrophobicContact CD2-CB 4.16Å; L154-V168 HydrophobicContact CD2-CG1 4.13Å; L154-V168 HydrophobicContact CD2-CG2 4.28Å; L154-V168 HydrophobicContact CG-CB 4.09Å; L154-V168 HydrophobicContact CG-CG2 4.06Å; L154-V168 WeakPolarHBondContact O-CB 3.35Å; L154-V168 PolarHBondContact O-N 2.82Å; H156-V168 HydrophobicContact CB-CG2 4.02Å; V168-L172 HydrophobicContact CG1-CB 3.93Å; V168-L172 HydrophobicContact CG1-CD2 3.84Å; V168-L172 HydrophobicContact CG1-CG 3.71Å; V168-A173 HydrophobicContact CG1-CB 4.12Å; V168-L176 HydrophobicContact CG1-CD1 4.27Å
169	R	97.9	Very high	95.7	Very high	48 Å²	48	48.8 Å²	48.8	18%	0.181	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-60.4	151.4	-179	76.3	173	177.9	178.5	-3.3	111	V113 F114 T115 H116 A171 L172 A173	V113-R169 HydrophobicContact CG1-CB 4.01Å; F114-R169 WeakPolarHBondContact O-CG 3.43Å; F114-R169 PolarHBondContact O-N 3.1Å; T115-R169 PolarHBondContact O-NE 2.82Å; T115-R169 PolarHBondContact O-NH2 2.65Å; H116-R169 PolarHBondContact CD2-NH2 2.88Å; H116-R169 PolarHBondContact CE1-NH2 3.4Å; H116-R169 PolarHBondContact NE2-NH2 2.97Å; R169-A171 VanDerWaalsContact C-N 3.3Å; R169-A171 PolarHBondContact O-N 2.91Å; R169-A171 VanDerWaalsContact O-N 3.16Å; R169-L172 HydrophobicContact CG-CB 3.96Å; R169-L172 PolarHBondContact O-N 3.18Å; R169-A173 PolarHBondContact O-N 3.42Å
170	S	97	Very high	95.6	Very high	81 Å²	81	48.5 Å²	48.5	57%	0.566	27%	0.272	S	S	*	.	H	α-helix	trans	-54.9	-40.1	-173	-50.1	0	0	0	0	114.4	A173 F174	S170-A173 PolarHBondContact O-N 3.39Å; S170-F174 WeakPolarHBondContact O-CB 3.36Å; S170-F174 PolarHBondContact O-N 3.01Å
171	A	97.3	Very high	95.7	Very high	47 Å²	47	42.4 Å²	42.4	39%	0.388	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-47.6	178	0	0	0	0	0	111.9	R169 F174 E175	R169-A171 VanDerWaalsContact C-N 3.3Å; R169-A171 PolarHBondContact O-N 2.91Å; R169-A171 VanDerWaalsContact O-N 3.16Å; A171-F174 WeakPolarHBondContact O-CB 3.22Å; A171-F174 PolarHBondContact O-N 3.31Å; A171-E175 WeakPolarHBondContact O-CG 3.24Å; A171-E175 PolarHBondContact O-N 2.99Å; A171-E175 VanDerWaalsContact O-N 3.11Å
172	L	97.8	Very high	95.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-70	-36.9	178.1	179	59.1	0	0	0	111.8	F114 L117 L127 V168 R169 F174 E175 L176	F114-L172 HydrophobicContact CB-CD2 4.26Å; L117-L172 HydrophobicContact CB-CD1 4.08Å; L127-L172 HydrophobicContact CD2-CD2 3.78Å; V168-L172 HydrophobicContact CG1-CB 3.93Å; V168-L172 HydrophobicContact CG1-CD2 3.84Å; V168-L172 HydrophobicContact CG1-CG 3.71Å; R169-L172 HydrophobicContact CG-CB 3.96Å; R169-L172 PolarHBondContact O-N 3.18Å; L172-F174 VanDerWaalsContact C-N 3.27Å; L172-F174 PolarHBondContact O-N 3.49Å; L172-E175 PolarHBondContact O-N 3.4Å; L172-L176 HydrophobicContact CD1-CD1 4.38Å; L172-L176 HydrophobicContact CD1-CG 4.3Å; L172-L176 HydrophobicContact CG-CD1 4.19Å; L172-L176 WeakPolarHBondContact O-CG 3.39Å; L172-L176 PolarHBondContact O-N 2.77Å
173	A	97.4	Very high	95.3	Very high	20 Å²	20	44.2 Å²	44.2	17%	0.165	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-37.8	174.7	0	0	0	0	0	111.6	L154 V168 R169 S170 L176 S177	L154-A173 HydrophobicContact CB-CB 3.94Å; L154-A173 HydrophobicContact CD2-CB 3.88Å; V168-A173 HydrophobicContact CG1-CB 4.12Å; R169-A173 PolarHBondContact O-N 3.42Å; S170-A173 PolarHBondContact O-N 3.39Å; A173-L176 PolarHBondContact O-N 3.34Å; A173-S177 WeakPolarHBondContact O-CB 3.43Å; A173-S177 PolarHBondContact O-N 3.36Å
174	F	96.4	Very high	94.8	Very high	162 Å²	162	49.4 Å²	49.4	71%	0.711	29%	0.286	S	S	*	.	H	α-helix	trans	-65	-44.2	174.5	-176.3	-97.1	0	0	0	111.7	S170 A171 L172 L176 S177	S170-F174 WeakPolarHBondContact O-CB 3.36Å; S170-F174 PolarHBondContact O-N 3.01Å; A171-F174 WeakPolarHBondContact O-CB 3.22Å; A171-F174 PolarHBondContact O-N 3.31Å; L172-F174 VanDerWaalsContact C-N 3.27Å; L172-F174 PolarHBondContact O-N 3.49Å; F174-L176 PolarHBondContact O-N 2.88Å; F174-S177 WeakPolarHBondContact O-CB 3.25Å; F174-S177 PolarHBondContact O-N 3.02Å; F174-S177 VanDerWaalsContact O-N 3.14Å; F174-S177 PolarHBondContact O-OG 2.99Å
175	E	95.9	Very high	93.9	Very high	120 Å²	120	52.5 Å²	52.5	56%	0.561	32%	0.318	S	S	*	.	H	α-helix	trans	-58.2	-46.6	174	-68.7	165.6	-153.7	0	0	111.9	A171 L172 S177	A171-E175 WeakPolarHBondContact O-CG 3.24Å; A171-E175 PolarHBondContact O-N 2.99Å; A171-E175 VanDerWaalsContact O-N 3.11Å; L172-E175 PolarHBondContact O-N 3.4Å; E175-S177 PolarHBondContact O-N 3Å
176	L	96.1	Very high	92.5	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.037	36%	0.359	C	S	.	.	H	α-helix	trans	-69.5	-19.7	178.5	-67.4	174.1	0	0	0	113.1	F140 L145 L154 V168 L172 A173 F174 A178 C179 W195	F140-L176 HydrophobicContact CE2-CD1 4.43Å; F140-L176 HydrophobicContact CZ-CD2 3.94Å; L145-L176 HydrophobicContact CD1-CD1 4.36Å; L145-L176 HydrophobicContact CD2-CD1 4.4Å; L154-L176 HydrophobicContact CD2-CB 4.48Å; L154-L176 HydrophobicContact CD2-CD1 4.2Å; V168-L176 HydrophobicContact CG1-CD1 4.27Å; L172-L176 HydrophobicContact CD1-CD1 4.38Å; L172-L176 HydrophobicContact CD1-CG 4.3Å; L172-L176 HydrophobicContact CG-CD1 4.19Å; L172-L176 WeakPolarHBondContact O-CG 3.39Å; L172-L176 PolarHBondContact O-N 2.77Å; A173-L176 PolarHBondContact O-N 3.34Å; F174-L176 PolarHBondContact O-N 2.88Å; L176-A178 PolarHBondContact O-N 3.35Å; L176-C179 WeakPolarHBondContact O-CB 3.39Å; L176-C179 PolarHBondContact O-N 3.09Å; L176-W195 HydrophobicContact CD2-CZ3 4.1Å
177	S	94.1	Very high	91.5	Very high	49 Å²	49	59.6 Å²	59.6	34%	0.343	37%	0.373	S	S	.	.	H	α-helix	trans	-62.5	-28.8	-176	76.2	0	0	0	0	113.3	A173 F174 E175 C179 F180	A173-S177 WeakPolarHBondContact O-CB 3.43Å; A173-S177 PolarHBondContact O-N 3.36Å; F174-S177 WeakPolarHBondContact O-CB 3.25Å; F174-S177 PolarHBondContact O-N 3.02Å; F174-S177 VanDerWaalsContact O-N 3.14Å; F174-S177 PolarHBondContact O-OG 2.99Å; E175-S177 PolarHBondContact O-N 3Å; S177-C179 PolarHBondContact O-N 3.11Å; S177-F180 PolarHBondContact O-N 3.16Å; S177-F180 VanDerWaalsContact O-N 3.09Å
178	A	93.5	Very high	90.7	Very high	84 Å²	84	63.9 Å²	63.9	69%	0.694	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.6	175.5	0	0	0	0	0	113.3	L176	L176-A178 PolarHBondContact O-N 3.35Å
179	C	94.6	Very high	90.2	Very high	30 Å²	30	66.4 Å²	66.4	20%	0.203	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-11.4	177.4	-61	0	0	0	0	113	L176 S177 V193 R194	L176-C179 WeakPolarHBondContact O-CB 3.39Å; L176-C179 PolarHBondContact O-N 3.09Å; S177-C179 PolarHBondContact O-N 3.11Å; C179-V193 HydrophobicContact CB-CG2 3.78Å; C179-V193 CarbonylContact O-C 3.55Å; C179-V193 WeakPolarHBondContact O-CA 3.49Å; C179-R194 WeakPolarHBondContact CB-O 3.27Å; C179-R194 PolarHBondContact O-N 2.57Å
180	F	95.5	Very high	90	Very high	23 Å²	23	64.5 Å²	64.5	10%	0.101	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	140.2	-176.6	-72.8	-49.5	0	0	0	113	L145 L154 S177 Y182 P190 V193 L202	L145-F180 HydrophobicContact CB-CE1 4.21Å; L145-F180 HydrophobicContact CB-CZ 4.17Å; L145-F180 HydrophobicContact CD1-CE1 4.07Å; L145-F180 HydrophobicContact CD1-CZ 3.89Å; L154-F180 HydrophobicContact CD1-CE2 4.17Å; L154-F180 HydrophobicContact CD1-CZ 3.76Å; L154-F180 HydrophobicContact CD2-CE2 4.14Å; L154-F180 HydrophobicContact CD2-CZ 4.12Å; S177-F180 PolarHBondContact O-N 3.16Å; S177-F180 VanDerWaalsContact O-N 3.09Å; F180-Y182 HydrophobicContact CB-CE2 4.4Å; F180-P190 HydrophobicContact CB-CB 3.69Å; F180-P190 HydrophobicContact CB-CG 4.07Å; F180-P190 HydrophobicContact CD1-CB 4.06Å; F180-P190 HydrophobicContact CD1-CG 3.88Å; F180-P190 HydrophobicContact CD2-CG 4.29Å; F180-P190 HydrophobicContact CE1-CG 4.43Å; F180-P190 HydrophobicContact CG-CB 3.97Å; F180-P190 HydrophobicContact CG-CG 3.83Å; F180-V193 HydrophobicContact CD1-CB 4.13Å; F180-V193 HydrophobicContact CD1-CG2 4.26Å; F180-V193 HydrophobicContact CE1-CB 4.27Å; F180-V193 HydrophobicContact CE1-CG2 4.3Å; F180-L202 HydrophobicContact CD1-CD1 4.33Å; F180-L202 HydrophobicContact CE1-CD1 4.16Å; F180-L202 HydrophobicContact CE1-CD2 4.29Å
181	E	94.3	Very high	89.8	Confident	49 Å²	49	62.7 Å²	62.7	23%	0.229	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.1	174.7	-68	-179.8	-176.7	0	0	110.5	P190 S191 H192 R194 R199	E181-P190 WeakPolarHBondContact O-CA 3.21Å; E181-P190 WeakPolarHBondContact O-CB 3.25Å; E181-S191 PolarHBondContact O-N 3.18Å; E181-S191 PolarHBondContact O-OG 2.75Å; E181-H192 HydrophobicContact CB-CB 4.18Å; E181-H192 PolarHBondContact N-O 2.92Å; E181-H192 PolarHBondContact O-N 3.09Å; E181-R194 IonicContact OE1-NE 2.97Å; E181-R199 WeakPolarHBondContact OE2-CD 3.22Å; E181-R199 IonicContact OE2-CZ 2.79Å; E181-R199 IonicContact OE2-NE 2.73Å; E181-R199 PolarHBondContact OE2-NE 3.48Å; E181-R199 IonicContact OE2-NH2 3.17Å
182	Y	91.7	Very high	89.7	Confident	135 Å²	135	62.2 Å²	62.2	53%	0.529	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-94.8	137.8	178.8	-63.5	-94.8	0	0	0	109.1	F180 P187 P190	F180-Y182 HydrophobicContact CB-CE2 4.4Å; Y182-P187 HydrophobicContact CD1-CG 4.43Å; Y182-P190 HydrophobicContact CD1-CB 4.24Å; Y182-P190 HydrophobicContact CE1-CB 4.06Å; Y182-P190 HydrophobicContact CE1-CG 4.46Å; Y182-P190 HydrophobicContact CE2-CB 4.49Å
183	G	82.8	Confident	89.7	Confident	22 Å²	22	62.2 Å²	62.2	23%	0.227	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-64.4	169.3	173.2	0	0	0	0	0	112.5	P187	G183-P187 WeakPolarHBondContact O-CD 3.24Å; G183-P187 VanDerWaalsContact O-CG 3.25Å; G183-P187 WeakPolarHBondContact O-CG 3.42Å
184	P	81.1	Confident	89.7	Confident	138 Å²	138	68.3 Å²	68.3	90%	0.896	41%	0.412	S	S	*	.	S	Bend	trans	-62.2	149.3	172.3	26.7	-33	0	0	0	111.2
185	G	77.3	Confident	89.6	Confident	78 Å²	78	62.5 Å²	62.5	80%	0.804	39%	0.386	S	S	*	.	S	Bend	trans	91.3	27.9	174.3	0	0	0	0	0	116.5
186	A	66.6	Low	89.3	Confident	103 Å²	103	64 Å²	64	85%	0.851	39%	0.393	S	S	*	.			trans	52.5	55	179	0	0	0	0	0	114.4
187	P	76.6	Confident	89.1	Confident	47 Å²	47	67.5 Å²	67.5	31%	0.305	43%	0.43	S	S	.	.			trans	-67.6	140.8	179.8	29.1	-33.3	0	0	0	110.9	Y182 G183 L189	Y182-P187 HydrophobicContact CD1-CG 4.43Å; G183-P187 WeakPolarHBondContact O-CD 3.24Å; G183-P187 VanDerWaalsContact O-CG 3.25Å; G183-P187 WeakPolarHBondContact O-CG 3.42Å; P187-L189 PolarHBondContact O-N 3.49Å
188	A	81.4	Confident	89.1	Confident	95 Å²	95	73.4 Å²	73.4	79%	0.785	44%	0.444	S	S	*	.	S	Bend	trans	-68	-17.5	179	0	0	0	0	0	113.6
189	L	88	Confident	89.2	Confident	55 Å²	55	76.3 Å²	76.3	29%	0.288	44%	0.438	S	S	.	.	S	Bend	trans	-131	148.1	179.9	-69.7	175.9	0	0	0	110.6	P147 A149 P187	P147-L189 HydrophobicContact CB-CD2 3.98Å; P147-L189 HydrophobicContact CG-CD2 4.18Å; A149-L189 HydrophobicContact CB-CD1 4.01Å; A149-L189 HydrophobicContact CB-CD2 3.86Å; A149-L189 HydrophobicContact CB-CG 3.99Å; P187-L189 PolarHBondContact O-N 3.49Å
190	P	93.8	Very high	89.4	Confident	9 Å²	9	76.9 Å²	76.9	6%	0.058	44%	0.438	C	S	.	.			trans	-69.6	151.7	173.1	33	-36.6	0	0	0	110.4	P147 F180 E181 Y182 L202	P147-P190 HydrophobicContact CB-CG 4.36Å; P147-P190 HydrophobicContact CG-CG 3.62Å; F180-P190 HydrophobicContact CB-CB 3.69Å; F180-P190 HydrophobicContact CB-CG 4.07Å; F180-P190 HydrophobicContact CD1-CB 4.06Å; F180-P190 HydrophobicContact CD1-CG 3.88Å; F180-P190 HydrophobicContact CD2-CG 4.29Å; F180-P190 HydrophobicContact CE1-CG 4.43Å; F180-P190 HydrophobicContact CG-CB 3.97Å; F180-P190 HydrophobicContact CG-CG 3.83Å; E181-P190 WeakPolarHBondContact O-CA 3.21Å; E181-P190 WeakPolarHBondContact O-CB 3.25Å; Y182-P190 HydrophobicContact CD1-CB 4.24Å; Y182-P190 HydrophobicContact CE1-CB 4.06Å; Y182-P190 HydrophobicContact CE1-CG 4.46Å; Y182-P190 HydrophobicContact CE2-CB 4.49Å; P190-L202 HydrophobicContact CB-CD1 4.39Å; P190-L202 HydrophobicContact CG-CD1 3.98Å
191	S	93.8	Very high	89.4	Confident	42 Å²	42	78.5 Å²	78.5	29%	0.294	46%	0.456	S	S	.	.			trans	-105.4	-24.9	179.5	58.2	0	0	0	0	112.2	E181 L202	E181-S191 PolarHBondContact O-N 3.18Å; E181-S191 PolarHBondContact O-OG 2.75Å; S191-L202 PolarHBondContact O-N 2.86Å
192	H	96.1	Very high	89.5	Confident	38 Å²	38	77 Å²	77	18%	0.176	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	160.5	-175.6	-63.1	72.1	0	0	0	110.5	E181 R199 L200	E181-H192 HydrophobicContact CB-CB 4.18Å; E181-H192 PolarHBondContact N-O 2.92Å; E181-H192 PolarHBondContact O-N 3.09Å; H192-R199 HydrophobicContact CB-CG 4.22Å; H192-R199 PolarHBondContact CD2-NH1 3.48Å; H192-R199 PolarHBondContact CD2-NH2 2.83Å; H192-R199 PolarHBondContact CE1-NH2 3.18Å; H192-R199 VanDerWaalsContact CG-CZ 3.43Å; H192-R199 VanDerWaalsContact CG-NH2 3.28Å; H192-R199 PolarHBondContact ND1-NH2 2.86Å; H192-R199 PolarHBondContact NE2-NH1 2.72Å; H192-R199 PolarHBondContact NE2-NH2 3.46Å; H192-L200 CarbonylContact C-O 3.5Å; H192-L200 WeakPolarHBondContact CA-O 3.33Å; H192-L200 WeakPolarHBondContact CB-O 3.48Å
193	V	96.9	Very high	89.7	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.006	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	134	168.7	63.4	0	0	0	0	108.9	P142 C179 F180 L200 L202	P142-V193 HydrophobicContact CB-CG1 3.91Å; P142-V193 HydrophobicContact CB-CG2 4.39Å; P142-V193 WeakPolarHBondContact O-CG1 3.29Å; C179-V193 HydrophobicContact CB-CG2 3.78Å; C179-V193 CarbonylContact O-C 3.55Å; C179-V193 WeakPolarHBondContact O-CA 3.49Å; F180-V193 HydrophobicContact CD1-CB 4.13Å; F180-V193 HydrophobicContact CD1-CG2 4.26Å; F180-V193 HydrophobicContact CE1-CB 4.27Å; F180-V193 HydrophobicContact CE1-CG2 4.3Å; V193-L200 HydrophobicContact CG1-CB 3.95Å; V193-L200 PolarHBondContact N-O 2.97Å; V193-L200 PolarHBondContact O-N 3.34Å; V193-L202 HydrophobicContact CB-CD2 4.05Å; V193-L202 HydrophobicContact CG1-CD2 3.89Å
194	R	96.8	Very high	90.2	Very high	148 Å²	148	76.7 Å²	76.7	56%	0.558	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	110.8	172.9	-173.4	168.1	60.1	174.4	-2.6	109	C179 E181 R198	C179-R194 WeakPolarHBondContact CB-O 3.27Å; C179-R194 PolarHBondContact O-N 2.57Å; E181-R194 IonicContact OE1-NE 2.97Å; R194-R198 CarbonylContact C-O 3.54Å; R194-R198 WeakPolarHBondContact CA-O 3.36Å
195	W	94.6	Very high	90.8	Very high	40 Å²	40	73.4 Å²	73.4	15%	0.152	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	125.8	-176.4	-167.4	-102.3	0	0	0	110.8	L117 P125 F140 P142 L176 G197 R198 L200	L117-W195 HydrophobicContact CD2-CH2 3.47Å; L117-W195 VanDerWaalsContact CD2-CH2 3.47Å; L117-W195 HydrophobicContact CD2-CZ2 4.01Å; P125-W195 HydrophobicContact CB-CZ2 4.42Å; P125-W195 HydrophobicContact CG-CZ2 4.32Å; F140-W195 HydrophobicContact CD1-CD2 4.4Å; F140-W195 AromaticContact CD1-CE2 3.76Å; F140-W195 HydrophobicContact CD1-CH2 4.15Å; F140-W195 AromaticContact CD1-CZ2 3.63Å; F140-W195 HydrophobicContact CD1-CZ2 3.63Å; F140-W195 AromaticContact CE1-CD2 3.69Å; F140-W195 HydrophobicContact CE1-CD2 3.69Å; F140-W195 AromaticContact CE1-CE2 3.48Å; F140-W195 VanDerWaalsContact CE1-CE2 3.48Å; F140-W195 AromaticContact CE1-CE3 3.8Å; F140-W195 HydrophobicContact CE1-CE3 3.8Å; F140-W195 HydrophobicContact CE1-CG 4.49Å; F140-W195 AromaticContact CE1-CH2 3.58Å; F140-W195 HydrophobicContact CE1-CH2 3.58Å; F140-W195 AromaticContact CE1-CZ2 3.43Å; F140-W195 HydrophobicContact CE1-CZ2 3.43Å; F140-W195 VanDerWaalsContact CE1-CZ2 3.43Å; F140-W195 AromaticContact CE1-CZ3 3.75Å; F140-W195 HydrophobicContact CE1-CZ3 3.75Å; F140-W195 HydrophobicContact CZ-CE3 4.47Å; F140-W195 HydrophobicContact CZ-CH2 4.43Å; F140-W195 HydrophobicContact CZ-CZ3 4.34Å; P142-W195 HydrophobicContact CB-CB 3.97Å; P142-W195 HydrophobicContact CB-CD2 4.33Å; P142-W195 HydrophobicContact CB-CG 3.95Å; P142-W195 HydrophobicContact CG-CB 3.98Å; P142-W195 HydrophobicContact CG-CD2 4.49Å; P142-W195 HydrophobicContact CG-CG 3.8Å; L176-W195 HydrophobicContact CD2-CZ3 4.1Å; W195-G197 VanDerWaalsContact C-N 3.26Å; W195-G197 PolarHBondContact O-N 2.69Å; W195-R198 PolarHBondContact N-O 3.35Å; W195-R198 WeakPolarHBondContact O-CB 3.33Å; W195-R198 PolarHBondContact O-N 3.39Å; W195-L200 HydrophobicContact CB-CD1 4.39Å
196	Q	90.6	Very high	91.6	Very high	152 Å²	152	69.8 Å²	69.8	71%	0.71	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	45.9	179.6	-65.2	177.4	-9.2	0	0	113.2	R198	Q196-R198 PolarHBondContact O-N 2.75Å
197	G	90.9	Very high	92.8	Very high	79 Å²	79	66.6 Å²	66.6	81%	0.814	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	-3.1	-179.6	0	0	0	0	0	115.3	W195	W195-G197 VanDerWaalsContact C-N 3.26Å; W195-G197 PolarHBondContact O-N 2.69Å
198	R	94.6	Very high	93.5	Very high	173 Å²	173	68.5 Å²	68.5	65%	0.653	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.4	177.7	-61.9	177.2	65.4	-175.2	0.4	110.7	R194 W195 Q196 L200	R194-R198 CarbonylContact C-O 3.54Å; R194-R198 WeakPolarHBondContact CA-O 3.36Å; W195-R198 PolarHBondContact N-O 3.35Å; W195-R198 WeakPolarHBondContact O-CB 3.33Å; W195-R198 PolarHBondContact O-N 3.39Å; Q196-R198 PolarHBondContact O-N 2.75Å; R198-L200 HydrophobicContact CB-CD2 4.41Å
199	R	96.4	Very high	93.8	Very high	146 Å²	146	67.6 Å²	67.6	55%	0.551	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	121	171.2	-174.4	176.3	-177.3	-90	-0.3	109.2	E181 H192	E181-R199 WeakPolarHBondContact OE2-CD 3.22Å; E181-R199 IonicContact OE2-CZ 2.79Å; E181-R199 IonicContact OE2-NE 2.73Å; E181-R199 PolarHBondContact OE2-NE 3.48Å; E181-R199 IonicContact OE2-NH2 3.17Å; H192-R199 HydrophobicContact CB-CG 4.22Å; H192-R199 PolarHBondContact CD2-NH1 3.48Å; H192-R199 PolarHBondContact CD2-NH2 2.83Å; H192-R199 PolarHBondContact CE1-NH2 3.18Å; H192-R199 VanDerWaalsContact CG-CZ 3.43Å; H192-R199 VanDerWaalsContact CG-NH2 3.28Å; H192-R199 PolarHBondContact ND1-NH2 2.86Å; H192-R199 PolarHBondContact NE2-NH1 2.72Å; H192-R199 PolarHBondContact NE2-NH2 3.46Å
200	L	97	Very high	93.6	Very high	41 Å²	41	66 Å²	66	22%	0.215	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.1	-175.6	-56.2	171.5	0	0	0	109.4	P142 A143 H192 V193 W195 R198	P142-L200 HydrophobicContact CB-CD1 4.3Å; P142-L200 HydrophobicContact CG-CD1 3.69Å; A143-L200 HydrophobicContact CB-CB 4.1Å; A143-L200 HydrophobicContact CB-CD1 4.41Å; H192-L200 CarbonylContact C-O 3.5Å; H192-L200 WeakPolarHBondContact CA-O 3.33Å; H192-L200 WeakPolarHBondContact CB-O 3.48Å; V193-L200 HydrophobicContact CG1-CB 3.95Å; V193-L200 PolarHBondContact N-O 2.97Å; V193-L200 PolarHBondContact O-N 3.34Å; W195-L200 HydrophobicContact CB-CD1 4.39Å; R198-L200 HydrophobicContact CB-CD2 4.41Å
201	A	96.5	Very high	92.7	Very high	58 Å²	58	72.5 Å²	72.5	48%	0.479	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	139.1	172.7	0	0	0	0	0	110.1	T203	A201-T203 PolarHBondContact O-N 2.82Å
202	L	96.9	Very high	91.1	Very high	18 Å²	18	74.5 Å²	74.5	9%	0.094	40%	0.402	C	S	.	.			trans	-72.4	126.3	172	-62.9	-177.9	0	0	0	109.1	A143 L145 P147 F180 P190 S191 V193 M204	A143-L202 WeakPolarHBondContact O-CA 3.19Å; L145-L202 HydrophobicContact CB-CD2 4.32Å; P147-L202 HydrophobicContact CG-CD1 4.18Å; F180-L202 HydrophobicContact CD1-CD1 4.33Å; F180-L202 HydrophobicContact CE1-CD1 4.16Å; F180-L202 HydrophobicContact CE1-CD2 4.29Å; P190-L202 HydrophobicContact CB-CD1 4.39Å; P190-L202 HydrophobicContact CG-CD1 3.98Å; S191-L202 PolarHBondContact O-N 2.86Å; V193-L202 HydrophobicContact CB-CD2 4.05Å; V193-L202 HydrophobicContact CG1-CD2 3.89Å; L202-M204 HydrophobicContact CB-SD 4.12Å
203	T	96.1	Very high	89.2	Confident	75 Å²	75	75 Å²	75	46%	0.46	41%	0.413	S	S	.	.			trans	-77.8	-25.6	-172	51.8	0	0	0	0	113.4	A143 A201 D205	A143-T203 HydrophobicContact CB-CG2 4.41Å; A143-T203 PolarHBondContact O-N 2.91Å; A143-T203 PolarHBondContact O-OG1 3.15Å; A201-T203 PolarHBondContact O-N 2.82Å; T203-D205 PolarHBondContact O-N 3.23Å; T203-D205 VanDerWaalsContact O-N 3.08Å; T203-D205 PolarHBondContact OG1-OD1 2.88Å; T203-D205 VanDerWaalsContact OG1-OD1 3.08Å
204	M	92.8	Very high	86.7	Confident	74 Å²	74	85.5 Å²	85.5	37%	0.365	45%	0.452	S	S	.	.			trans	57.8	16.4	-178.7	-49.2	-60.6	-83.3	0	0	114.9	L146 L202 L206 A207	L146-M204 HydrophobicContact CD1-CB 4.37Å; L146-M204 HydrophobicContact CD1-CE 3.46Å; L146-M204 VanDerWaalsContact CD1-CE 3.46Å; L146-M204 HydrophobicContact CD1-SD 3.52Å; L146-M204 VanDerWaalsContact CD1-SD 3.52Å; L202-M204 HydrophobicContact CB-SD 4.12Å; M204-L206 VanDerWaalsContact C-N 3.26Å; M204-L206 PolarHBondContact O-N 3.45Å; M204-A207 WeakPolarHBondContact O-CB 3.33Å; M204-A207 PolarHBondContact O-N 3.42Å
205	D	93.6	Very high	83.7	Confident	69 Å²	69	83.3 Å²	83.3	37%	0.369	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-20.4	-173.8	68.2	-36.1	0	0	0	113.8	R144 T203 P208	R144-D205 IonicContact CZ-OD2 3.45Å; R144-D205 IonicContact NE-OD1 2.66Å; R144-D205 IonicContact NE-OD2 2.79Å; R144-D205 PolarHBondContact NE-OD2 3.14Å; R144-D205 IonicContact NH2-OD2 3.37Å; R144-D205 PolarHBondContact NH2-OD2 3.37Å; T203-D205 PolarHBondContact O-N 3.23Å; T203-D205 VanDerWaalsContact O-N 3.08Å; T203-D205 PolarHBondContact OG1-OD1 2.88Å; T203-D205 VanDerWaalsContact OG1-OD1 3.08Å; D205-P208 WeakPolarHBondContact O-CD 2.93Å
206	L	94.4	Very high	80.8	Confident	3 Å²	3	91 Å²	91	2%	0.016	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.4	177.4	-62.1	179	0	0	0	114.2	R144 L146 P157 V165 M204 P208 L209 L210	R144-L206 WeakPolarHBondContact O-CD1 3.44Å; L146-L206 HydrophobicContact CB-CB 4.26Å; L146-L206 HydrophobicContact CB-CD1 4.3Å; L146-L206 HydrophobicContact CD2-CB 3.62Å; P157-L206 HydrophobicContact CG-CD1 4Å; P157-L206 HydrophobicContact CG-CD2 4.16Å; P157-L206 HydrophobicContact CG-CG 4.44Å; V165-L206 HydrophobicContact CB-CD2 4.42Å; V165-L206 HydrophobicContact CG2-CB 4.46Å; V165-L206 HydrophobicContact CG2-CD1 3.93Å; M204-L206 VanDerWaalsContact C-N 3.26Å; M204-L206 PolarHBondContact O-N 3.45Å; L206-P208 VanDerWaalsContact C-CD 3.45Å; L206-L209 HydrophobicContact CD2-CD1 4.18Å; L206-L209 WeakPolarHBondContact O-CB 3.15Å; L206-L209 PolarHBondContact O-N 3.37Å; L206-L210 PolarHBondContact O-N 2.88Å
207	A	91.5	Very high	80.3	Confident	36 Å²	36	88 Å²	88	30%	0.298	50%	0.502	S	S	.	.	H	α-helix	trans	-56.7	-40.7	-173.9	0	0	0	0	0	113.9	L146 M204 L209 L210 L211	L146-A207 HydrophobicContact CD2-CB 4.22Å; M204-A207 WeakPolarHBondContact O-CB 3.33Å; M204-A207 PolarHBondContact O-N 3.42Å; A207-L209 VanDerWaalsContact C-N 3.29Å; A207-L209 PolarHBondContact O-N 2.97Å; A207-L210 PolarHBondContact O-N 3.16Å; A207-L210 VanDerWaalsContact O-N 3.12Å; A207-L211 PolarHBondContact O-N 2.98Å
208	P	90.8	Very high	79.7	Confident	86 Å²	86	88.4 Å²	88.4	56%	0.558	49%	0.486	S	S	*	.	H	α-helix	trans	-60.3	-35.4	176.1	-24.2	35.8	0	0	0	113.6	D205 L206 L210 L211 A212	D205-P208 WeakPolarHBondContact O-CD 2.93Å; L206-P208 VanDerWaalsContact C-CD 3.45Å; P208-L210 VanDerWaalsContact C-N 3.28Å; P208-L210 PolarHBondContact O-N 2.91Å; P208-L211 PolarHBondContact O-N 3.18Å; P208-A212 WeakPolarHBondContact O-CB 3.49Å; P208-A212 PolarHBondContact O-N 2.84Å
209	L	87.6	Confident	78.9	Confident	76 Å²	76	83.7 Å²	83.7	40%	0.398	48%	0.477	S	S	.	.	H	α-helix	trans	-72.3	-21.5	178.6	-60.2	178.8	0	0	0	112.8	R110 V165 L206 A207 A213	R110-L209 PolarHBondContact NH2-O 3.22Å; V165-L209 HydrophobicContact CG1-CB 3.97Å; L206-L209 HydrophobicContact CD2-CD1 4.18Å; L206-L209 WeakPolarHBondContact O-CB 3.15Å; L206-L209 PolarHBondContact O-N 3.37Å; A207-L209 VanDerWaalsContact C-N 3.29Å; A207-L209 PolarHBondContact O-N 2.97Å; L209-A213 WeakPolarHBondContact O-CB 3.36Å
210	L	85.1	Confident	77.9	Confident	22 Å²	22	80.1 Å²	80.1	12%	0.115	47%	0.472	C	S	.	.	H	α-helix	trans	-81	-35.3	173.2	-61.3	-170.9	0	0	0	112	L146 L148 Y155 V165 L206 A207 P208	L146-L210 HydrophobicContact CD2-CD1 3.44Å; L146-L210 VanDerWaalsContact CD2-CD1 3.44Å; L146-L210 HydrophobicContact CD2-CG 4.11Å; L146-L210 HydrophobicContact CG-CD1 4.33Å; L148-L210 HydrophobicContact CB-CD1 4.41Å; L148-L210 HydrophobicContact CD1-CD1 4.47Å; L148-L210 HydrophobicContact CD2-CD1 3.98Å; Y155-L210 HydrophobicContact CD1-CD1 4.47Å; Y155-L210 HydrophobicContact CD1-CD2 3.85Å; Y155-L210 HydrophobicContact CD2-CD1 3.53Å; Y155-L210 HydrophobicContact CD2-CD2 4.35Å; Y155-L210 HydrophobicContact CE1-CD2 3.99Å; Y155-L210 HydrophobicContact CE2-CD1 3.76Å; Y155-L210 HydrophobicContact CE2-CD2 4.48Å; Y155-L210 HydrophobicContact CG-CD1 3.92Å; Y155-L210 HydrophobicContact CG-CD2 4.04Å; V165-L210 HydrophobicContact CG1-CD2 3.85Å; V165-L210 HydrophobicContact CG2-CD2 3.98Å; L206-L210 PolarHBondContact O-N 2.88Å; A207-L210 PolarHBondContact O-N 3.16Å; A207-L210 VanDerWaalsContact O-N 3.12Å; P208-L210 VanDerWaalsContact C-N 3.28Å; P208-L210 PolarHBondContact O-N 2.91Å
211	L	73.6	Confident	76.7	Confident	145 Å²	145	82.5 Å²	82.5	76%	0.759	49%	0.488	S	S	*	.	H	α-helix	trans	-75.5	-37.9	178.9	-66	170.5	0	0	0	112.4	A207 P208 A213	A207-L211 PolarHBondContact O-N 2.98Å; P208-L211 PolarHBondContact O-N 3.18Å; L211-A213 VanDerWaalsContact C-N 3.3Å; L211-A213 PolarHBondContact O-N 2.71Å
212	A	61.1	Low	75.4	Confident	85 Å²	85	84.1 Å²	84.1	70%	0.702	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.6	179.4	0	0	0	0	0	114	P208 R214	P208-A212 WeakPolarHBondContact O-CB 3.49Å; P208-A212 PolarHBondContact O-N 2.84Å; A212-R214 VanDerWaalsContact C-N 3.33Å; A212-R214 PolarHBondContact O-N 2.92Å
213	A	56	Low	73.8	Confident	48 Å²	48	88.9 Å²	88.9	40%	0.397	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	7.9	-173.1	0	0	0	0	0	114.3	R110 L209 L211 P215	R110-A213 VanDerWaalsContact NH2-CB 3.27Å; L209-A213 WeakPolarHBondContact O-CB 3.36Å; L211-A213 VanDerWaalsContact C-N 3.3Å; L211-A213 PolarHBondContact O-N 2.71Å; A213-P215 VanDerWaalsContact O-CD 3.22Å; A213-P215 WeakPolarHBondContact O-CD 3.5Å
214	R	43.3	Very low	72.1	Confident	222 Å²	222	89.9 Å²	89.9	84%	0.838	52%	0.522	S	S	*	.			trans	-75.3	112.4	174.5	-139.7	177.2	170.2	145.5	-2.7	107.8	A212	A212-R214 VanDerWaalsContact C-N 3.33Å; A212-R214 PolarHBondContact O-N 2.92Å
215	P	35.3	Very low	70.4	Confident	102 Å²	102	91.3 Å²	91.3	66%	0.662	54%	0.535	S	S	*	.			trans	-63.4	148.8	165.8	-3.7	21.1	0	0	0	107.9	A213	A213-P215 VanDerWaalsContact O-CD 3.22Å; A213-P215 WeakPolarHBondContact O-CD 3.5Å
216	P	32.4	Very low	68.3	Low	201 Å²	201	93.3 Å²	93.3	100%	1.305	55%	0.55	S	S	*	.			trans	-55.7	0	172.4	25.8	-34.3	0	0	0	112.2

Retrieved 216 of 216 residues in 1090.7 ms (Link to these results)

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