G4VLI9_SCHMA Loading...

DNA-directed RNA polymerase subunit

DNA-dependent RNA polymerase catalyzes the transcription of DNA into RNA using the four ribonucleoside triphosphates as substrates.

AlphaFold DB , UniProt , Accession G4VLI9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 470 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51	Low	80.9	Confident	234 Å²	234	141.7 Å²	141.7	100%	1.153	77%	0.768	S	S	*	*				0	136.7	0	-68.8	-165.9	171.4	0	0	107.9	S3	M1-S3 PolarHBondContact O-N 3.42Å
2	P	69	Low	81.8	Confident	126 Å²	126	149.9 Å²	149.9	82%	0.818	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-57.4	132.8	171.2	24.6	-30.5	0	0	0	108.2	L4	P2-L4 PolarHBondContact O-N 2.89Å
3	S	79.3	Confident	82.8	Confident	118 Å²	118	150.8 Å²	150.8	83%	0.825	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.8	125.8	175.5	46.5	0	0	0	0	108.4	M1 Y5	M1-S3 PolarHBondContact O-N 3.42Å; S3-Y5 PolarHBondContact O-N 3.28Å
4	L	84.2	Confident	83.6	Confident	166 Å²	166	148.4 Å²	148.4	87%	0.869	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-57.5	137.4	172.5	-68.2	169.5	0	0	0	108.2	P2 K6	P2-L4 PolarHBondContact O-N 2.89Å; L4-K6 PolarHBondContact O-N 3Å; L4-K6 VanDerWaalsContact O-N 3.09Å
5	Y	85.8	Confident	84.4	Confident	194 Å²	194	151.2 Å²	151.2	76%	0.761	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-58.1	117.8	176.6	172.9	-99.4	0	0	0	109.5	S3 P7	S3-Y5 PolarHBondContact O-N 3.28Å; Y5-P7 HydrophobicContact CE1-CB 3.94Å
6	K	85.1	Confident	84.8	Confident	156 Å²	156	147.4 Å²	147.4	68%	0.678	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-99.4	118.1	168.8	-172	-174.5	173.8	-162.4	0	107.2	L4 D9	L4-K6 PolarHBondContact O-N 3Å; L4-K6 VanDerWaalsContact O-N 3.09Å; K6-D9 IonicContact NZ-OD1 2.64Å
7	P	83.6	Confident	85.2	Confident	78 Å²	78	146.1 Å²	146.1	51%	0.506	76%	0.759	S	S	.	*	P	Polyproline II helix	trans	-59.4	149.5	174.8	23.3	-30.7	0	0	0	110.3	Y5	Y5-P7 HydrophobicContact CE1-CB 3.94Å
8	P	85.3	Confident	85.2	Confident	91 Å²	91	144.9 Å²	144.9	59%	0.591	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-60.4	147.1	178.7	26.1	-33.8	0	0	0	110.6	L10	P8-L10 PolarHBondContact O-N 3.36Å
9	D	85.8	Confident	85.4	Confident	138 Å²	138	147.4 Å²	147.4	74%	0.738	75%	0.752	S	S	*	*			trans	-67.3	98.7	179	-67.2	-39.3	0	0	0	109.4	K6	K6-D9 IonicContact NZ-OD1 2.64Å
10	L	89.3	Confident	85.5	Confident	133 Å²	133	145.7 Å²	145.7	70%	0.696	74%	0.741	S	S	*	*			trans	-74.2	126	179.1	-70.8	169.8	0	0	0	110	P8 R12	P8-L10 PolarHBondContact O-N 3.36Å; L10-R12 PolarHBondContact O-N 3.25Å
11	P	91.4	Very high	85.6	Confident	125 Å²	125	139.7 Å²	139.7	81%	0.812	71%	0.711	S	S	*	*			trans	-64.1	133.1	175.9	27.1	-33.1	0	0	0	109.7
12	R	92.2	Very high	87.4	Confident	240 Å²	240	131.6 Å²	131.6	91%	0.906	68%	0.676	S	S	*	*			trans	-112.1	147.2	177.7	-61.7	-168.1	-177.4	-138	1.7	110.6	L10	L10-R12 PolarHBondContact O-N 3.25Å
13	I	94.1	Very high	88.4	Confident	162 Å²	162	127 Å²	127	83%	0.831	65%	0.647	S	S	*	*			trans	-114.9	138.6	176.6	-57	175.1	0	0	0	107.7	E15	I13-E15 PolarHBondContact O-N 3.42Å
14	V	94.6	Very high	89	Confident	117 Å²	117	123.5 Å²	123.5	71%	0.709	62%	0.618	S	S	*	*			trans	-77	117.6	173.8	179.4	0	0	0	0	108.4	I17	V14-I17 HydrophobicContact CG1-CG1 4.29Å
15	E	95	Very high	89.3	Confident	190 Å²	190	117.5 Å²	117.5	89%	0.888	60%	0.596	S	S	*	*			trans	-87.6	-49.6	-179.8	-175.8	179.2	-177.5	0	0	112	I13	I13-E15 PolarHBondContact O-N 3.42Å
16	D	91.5	Very high	89.6	Confident	91 Å²	91	110.4 Å²	110.4	49%	0.487	57%	0.571	S	S	.	*			trans	-140.9	164	-179.7	72.3	43	0	0	0	112.3	K18	D16-K18 WeakPolarHBondContact OD1-CE 3.42Å; D16-K18 WeakPolarHBondContact OD2-CE 3.45Å; D16-K18 IonicContact OD2-NZ 2.64Å
17	I	90.7	Very high	90	Very high	124 Å²	124	103.6 Å²	103.6	64%	0.636	54%	0.542	S	S	*	.			trans	-126.2	121	172.8	-58.8	176.2	0	0	0	107.8	V14 F19	V14-I17 HydrophobicContact CG1-CG1 4.29Å; I17-F19 HydrophobicContact CG2-CE1 4.46Å; I17-F19 HydrophobicContact CG2-CE2 4.08Å; I17-F19 HydrophobicContact CG2-CZ 4Å
18	K	85.9	Confident	90.6	Very high	125 Å²	125	105.6 Å²	105.6	54%	0.543	54%	0.543	S	S	.	.			trans	-105.5	124.1	179.1	-65.6	176.4	-174.2	168.4	0	110.3	D16 W243	D16-K18 WeakPolarHBondContact OD1-CE 3.42Å; D16-K18 WeakPolarHBondContact OD2-CE 3.45Å; D16-K18 IonicContact OD2-NZ 2.64Å; K18-W243 HydrophobicContact CD-CH2 4.4Å; K18-W243 HydrophobicContact CD-CZ3 4.29Å
19	F	88.8	Confident	91	Very high	192 Å²	192	111 Å²	111	84%	0.842	55%	0.551	S	S	*	*			trans	-93.1	130.4	178.1	-64.4	-85.8	0	0	0	110.5	I17	I17-F19 HydrophobicContact CG2-CE1 4.46Å; I17-F19 HydrophobicContact CG2-CE2 4.08Å; I17-F19 HydrophobicContact CG2-CZ 4Å
20	Q	86.5	Confident	91.4	Very high	113 Å²	113	109.5 Å²	109.5	53%	0.528	54%	0.543	S	S	.	.			trans	-138.3	159.8	177.3	67.4	179.8	5.8	0	0	111.4
21	L	89.4	Confident	91.8	Very high	20 Å²	20	104 Å²	104	11%	0.105	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-76.9	126	170	-63.7	174.2	0	0	0	109.1	S23 Y97 M237 T245 N249 L250	L21-S23 PolarHBondContact O-N 3.48Å; L21-Y97 HydrophobicContact CD2-CD2 4.35Å; L21-Y97 HydrophobicContact CD2-CE1 4.37Å; L21-Y97 HydrophobicContact CD2-CE2 3.6Å; L21-M237 HydrophobicContact CD1-CE 3.79Å; L21-T245 HydrophobicContact CB-CG2 4.27Å; L21-T245 HydrophobicContact CD1-CG2 3.87Å; L21-T245 HydrophobicContact CG-CG2 4.03Å; L21-N249 HydrophobicContact CB-CB 3.91Å; L21-N249 HydrophobicContact CD1-CB 4.31Å; L21-L250 HydrophobicContact CD1-CD2 3.43Å; L21-L250 VanDerWaalsContact CD1-CD2 3.43Å; L21-L250 HydrophobicContact CD1-CG 3.91Å; L21-L250 HydrophobicContact CD2-CD2 4.04Å; L21-L250 HydrophobicContact CG-CD2 4.39Å
22	C	88	Confident	92.1	Very high	64 Å²	64	103.2 Å²	103.2	43%	0.432	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-68.8	126.1	174.1	-166.4	0	0	0	0	109.7
23	S	90.3	Very high	92.3	Very high	29 Å²	29	92.1 Å²	92.1	20%	0.203	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-80.1	163.7	170.4	73	0	0	0	0	111.2	L21 G25 D26 L27	L21-S23 PolarHBondContact O-N 3.48Å; S23-G25 PolarHBondContact O-N 2.9Å; S23-G25 PolarHBondContact OG-N 3.43Å; S23-D26 WeakPolarHBondContact CB-OD2 3.25Å; S23-D26 PolarHBondContact N-OD2 3.17Å; S23-D26 VanDerWaalsContact N-OD2 3.11Å; S23-D26 PolarHBondContact O-N 3.42Å; S23-D26 PolarHBondContact OG-N 3.46Å; S23-D26 PolarHBondContact OG-OD2 3.38Å; S23-L27 PolarHBondContact O-N 2.9Å
24	E	91.1	Very high	92.5	Very high	46 Å²	46	87.5 Å²	87.5	22%	0.215	43%	0.434	C	S	.	.	H	α-helix	trans	-56.7	-37.4	171.6	-69.6	163.2	-153.5	0	0	111.7	K28 M221 R248 R254	E24-K28 WeakPolarHBondContact O-CB 3.43Å; E24-K28 PolarHBondContact O-N 3.01Å; E24-M221 WeakPolarHBondContact OE1-CE 3.42Å; E24-R248 IonicContact OE1-NH2 2.72Å; E24-R248 IonicContact OE2-NH2 3.64Å; E24-R254 HydrophobicContact CG-CB 4.15Å; E24-R254 PolarHBondContact O-NH1 3.32Å
25	G	91.4	Very high	92.6	Very high	40 Å²	40	82 Å²	82	41%	0.412	40%	0.401	S	S	.	.	H	α-helix	trans	-68.3	-42.3	178	0	0	0	0	0	112.7	S23 K28 R29	S23-G25 PolarHBondContact O-N 2.9Å; S23-G25 PolarHBondContact OG-N 3.43Å; G25-K28 PolarHBondContact O-N 3.18Å; G25-R29 WeakPolarHBondContact O-CB 3.38Å; G25-R29 PolarHBondContact O-N 3.14Å
26	D	91.4	Very high	92.6	Very high	44 Å²	44	78.2 Å²	78.2	24%	0.235	39%	0.386	C	S	.	.	H	α-helix	trans	-63.4	-45.4	175.8	-60.9	-43.4	0	0	0	110.7	S23 K28 R29 L30	S23-D26 WeakPolarHBondContact CB-OD2 3.25Å; S23-D26 PolarHBondContact N-OD2 3.17Å; S23-D26 VanDerWaalsContact N-OD2 3.11Å; S23-D26 PolarHBondContact O-N 3.42Å; S23-D26 PolarHBondContact OG-N 3.46Å; S23-D26 PolarHBondContact OG-OD2 3.38Å; D26-K28 VanDerWaalsContact C-N 3.34Å; D26-K28 PolarHBondContact O-N 2.93Å; D26-R29 WeakPolarHBondContact O-CB 3.15Å; D26-R29 PolarHBondContact O-N 3.09Å; D26-R29 VanDerWaalsContact O-N 3.14Å; D26-L30 WeakPolarHBondContact O-CB 3.33Å; D26-L30 WeakPolarHBondContact O-CG 3.41Å; D26-L30 PolarHBondContact O-N 2.95Å
27	L	94.2	Very high	92.7	Very high	13 Å²	13	78.1 Å²	78.1	7%	0.068	38%	0.382	C	S	.	.	H	α-helix	trans	-62.9	-41.6	179.7	-178.7	52.3	0	0	0	111.8	S23 R29 L30 S31 R254 P256	S23-L27 PolarHBondContact O-N 2.9Å; L27-R29 VanDerWaalsContact C-N 3.32Å; L27-R29 PolarHBondContact O-N 2.95Å; L27-L30 PolarHBondContact O-N 3.16Å; L27-S31 VanDerWaalsContact O-CB 3.31Å; L27-S31 WeakPolarHBondContact O-CB 3.23Å; L27-S31 PolarHBondContact O-N 3.48Å; L27-S31 VanDerWaalsContact O-N 3.07Å; L27-S31 PolarHBondContact O-OG 3.39Å; L27-R254 HydrophobicContact CD2-CB 4.22Å; L27-R254 HydrophobicContact CD2-CG 3.6Å; L27-R254 HydrophobicContact CG-CG 4.16Å; L27-P256 HydrophobicContact CD1-CB 3.65Å; L27-P256 HydrophobicContact CD2-CB 3.92Å; L27-P256 HydrophobicContact CD2-CG 4.36Å; L27-P256 HydrophobicContact CG-CB 4.46Å
28	K	95	Very high	92.6	Very high	120 Å²	120	74.1 Å²	74.1	52%	0.522	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-39.7	174.1	-174	172	-175.2	176.8	0	111.9	E24 G25 D26 S31 Y85	E24-K28 WeakPolarHBondContact O-CB 3.43Å; E24-K28 PolarHBondContact O-N 3.01Å; G25-K28 PolarHBondContact O-N 3.18Å; D26-K28 VanDerWaalsContact C-N 3.34Å; D26-K28 PolarHBondContact O-N 2.93Å; K28-S31 PolarHBondContact O-N 2.78Å; K28-Y85 HydrophobicContact CB-CE1 4.43Å; K28-Y85 HydrophobicContact CG-CE1 4.03Å
29	R	95	Very high	92.8	Very high	205 Å²	205	72.4 Å²	72.4	77%	0.774	36%	0.36	S	S	*	.	H	α-helix	trans	-68.1	-36.2	178.2	-170	-174	-61.1	152.7	3.2	112.6	G25 D26 L27 S31	G25-R29 WeakPolarHBondContact O-CB 3.38Å; G25-R29 PolarHBondContact O-N 3.14Å; D26-R29 WeakPolarHBondContact O-CB 3.15Å; D26-R29 PolarHBondContact O-N 3.09Å; D26-R29 VanDerWaalsContact O-N 3.14Å; L27-R29 VanDerWaalsContact C-N 3.32Å; L27-R29 PolarHBondContact O-N 2.95Å; R29-S31 VanDerWaalsContact C-N 3.34Å
30	L	94.2	Very high	92.8	Very high	107 Å²	107	64.2 Å²	64.2	56%	0.56	33%	0.325	S	S	*	.	H	α-helix	trans	-74.4	-25.3	178.5	-76.2	162.9	0	0	0	113.1	D26 L27	D26-L30 WeakPolarHBondContact O-CB 3.33Å; D26-L30 WeakPolarHBondContact O-CG 3.41Å; D26-L30 PolarHBondContact O-N 2.95Å; L27-L30 PolarHBondContact O-N 3.16Å
31	S	97.2	Very high	92.9	Very high	17 Å²	17	60.4 Å²	60.4	12%	0.119	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	141.2	-171.7	-60.5	0	0	0	0	112.3	L27 K28 R29 W83 G84 Y85	L27-S31 VanDerWaalsContact O-CB 3.31Å; L27-S31 WeakPolarHBondContact O-CB 3.23Å; L27-S31 PolarHBondContact O-N 3.48Å; L27-S31 VanDerWaalsContact O-N 3.07Å; L27-S31 PolarHBondContact O-OG 3.39Å; K28-S31 PolarHBondContact O-N 2.78Å; R29-S31 VanDerWaalsContact C-N 3.34Å; S31-W83 CarbonylContact C-O 3.54Å; S31-W83 VanDerWaalsContact CA-O 3.3Å; S31-W83 WeakPolarHBondContact CA-O 3.39Å; S31-G84 PolarHBondContact OG-O 2.73Å; S31-Y85 VanDerWaalsContact CB-CD1 3.45Å
32	H	97	Very high	92.5	Very high	109 Å²	109	60.8 Å²	60.8	51%	0.505	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-26.3	176.2	-77.7	-86.4	0	0	0	113.3	T71 H82 W83	H32-T71 WeakPolarHBondContact CE1-CG2 3.36Å; H32-T71 VanDerWaalsContact ND1-CG2 3.35Å; H32-T71 WeakPolarHBondContact ND1-CG2 3.39Å; H32-H82 HydrophobicContact CB-CB 4.48Å; H32-H82 AromaticContact CD2-CG 3.9Å; H32-H82 AromaticContact CD2-ND1 3.62Å; H32-H82 AromaticContact NE2-ND1 3.36Å; H32-H82 PolarHBondContact NE2-ND1 3.44Å; H32-W83 PolarHBondContact N-O 3.26Å
33	I	97.1	Very high	91.9	Very high	6 Å²	6	65.8 Å²	65.8	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.8	-179.3	69.1	170	0	0	0	111.9	V35 D57 R59 L60 G84 Y85	I33-V35 HydrophobicContact CD1-CG2 4.05Å; I33-V35 HydrophobicContact CG1-CG2 4.29Å; I33-D57 HydrophobicContact CD1-CB 3.58Å; I33-R59 HydrophobicContact CG2-CB 3.54Å; I33-R59 HydrophobicContact CG2-CG 4.16Å; I33-L60 HydrophobicContact CD1-CD1 3.98Å; I33-L60 HydrophobicContact CD1-CD2 3.72Å; I33-L60 HydrophobicContact CD1-CG 3.6Å; I33-L60 HydrophobicContact CG1-CD2 3.64Å; I33-L60 HydrophobicContact CG1-CG 4.12Å; I33-G84 VanDerWaalsContact O-CA 3.27Å; I33-G84 WeakPolarHBondContact O-CA 3.21Å; I33-Y85 PolarHBondContact O-N 2.98Å; I33-Y85 VanDerWaalsContact O-N 3.08Å
34	Q	97.6	Very high	90.8	Very high	66 Å²	66	68.8 Å²	68.8	31%	0.308	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.3	161.1	-175.2	169.4	-8.8	0	0	108.6	L36 Y53 Y85	Q34-L36 HydrophobicContact CG-CD2 3.81Å; Q34-L36 HydrophobicContact CG-CG 4.41Å; Q34-Y53 WeakPolarHBondContact O-CD1 3.4Å; Q34-Y85 CarbonylContact C-O 3.54Å; Q34-Y85 VanDerWaalsContact CA-O 3.31Å; Q34-Y85 WeakPolarHBondContact CA-O 3.47Å; Q34-Y85 HydrophobicContact CB-CE1 4.08Å; Q34-Y85 HydrophobicContact CB-CE2 4.05Å; Q34-Y85 HydrophobicContact CG-CD2 4.22Å; Q34-Y85 HydrophobicContact CG-CE2 3.65Å; Q34-Y85 PolarHBondContact OE1-OH 3.47Å
35	V	97.2	Very high	89.4	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.012	38%	0.377	C	S	.	.			trans	-80.3	129.4	174.2	179.6	0	0	0	0	108.4	I33 L55 Y85 F86 V257 L287	I33-V35 HydrophobicContact CD1-CG2 4.05Å; I33-V35 HydrophobicContact CG1-CG2 4.29Å; V35-L55 HydrophobicContact CG1-CD2 3.91Å; V35-L55 HydrophobicContact CG1-CG 4.14Å; V35-Y85 PolarHBondContact N-O 2.95Å; V35-F86 HydrophobicContact CB-CB 4.44Å; V35-F86 VanDerWaalsContact O-CB 3.26Å; V35-F86 WeakPolarHBondContact O-CB 3.23Å; V35-V257 HydrophobicContact CB-CG2 4.4Å; V35-V257 HydrophobicContact CG2-CB 4.41Å; V35-V257 HydrophobicContact CG2-CG1 4.44Å; V35-V257 HydrophobicContact CG2-CG2 4Å; V35-L287 HydrophobicContact CG1-CD1 3.74Å
36	L	95	Very high	88.1	Confident	110 Å²	110	75.4 Å²	75.4	58%	0.576	40%	0.398	S	S	*	.			trans	-123	-23.6	-176.1	-60.2	175.8	0	0	0	112.2	Q34 Y53	Q34-L36 HydrophobicContact CG-CD2 3.81Å; Q34-L36 HydrophobicContact CG-CG 4.41Å; L36-Y53 PolarHBondContact N-O 2.84Å
37	K	93.6	Very high	87	Confident	89 Å²	89	79.7 Å²	79.7	39%	0.387	42%	0.421	S	S	.	.			trans	-106.8	131	-175	-60.7	178	-172.2	160.3	0	110.8	L51 D52 Y53	K37-L51 HydrophobicContact CD-CB 4.26Å; K37-L51 HydrophobicContact CD-CD1 4.28Å; K37-D52 WeakPolarHBondContact CD-O 3.42Å; K37-D52 WeakPolarHBondContact CE-O 3.25Å; K37-D52 PolarHBondContact NZ-O 3.42Å; K37-Y53 PolarHBondContact N-O 2.98Å
38	C	89.6	Confident	86.2	Confident	39 Å²	39	83.5 Å²	83.5	26%	0.264	44%	0.435	S	S	.	.			trans	-81.5	-24.4	173.7	63.9	0	0	0	0	112.8	Q284 L287	C38-Q284 HydrophobicContact CB-CG 4.49Å; C38-Q284 WeakPolarHBondContact O-CG 3.3Å; C38-Q284 PolarHBondContact O-NE2 3.3Å; C38-L287 HydrophobicContact CB-CB 3.74Å
39	L	89.2	Confident	85.6	Confident	89 Å²	89	85.2 Å²	85.2	47%	0.466	44%	0.438	S	S	.	.			trans	-69.1	142.9	174.6	-66.6	175.8	0	0	0	110.7	L51	L39-L51 HydrophobicContact CB-CD1 3.57Å
40	L	88.6	Confident	85.3	Confident	20 Å²	20	76.2 Å²	76.2	11%	0.105	41%	0.407	C	S	.	.			trans	-90.9	-39.5	-174.7	-59.3	176.7	0	0	0	112.7	A50 L51 L55 L56 E276 I280	L40-A50 WeakPolarHBondContact O-CA 3.36Å; L40-L51 PolarHBondContact O-N 2.82Å; L40-L55 HydrophobicContact CD2-CB 3.89Å; L40-L55 HydrophobicContact CD2-CD1 4.02Å; L40-L56 HydrophobicContact CB-CD1 4.12Å; L40-L56 HydrophobicContact CD2-CD1 4.42Å; L40-L56 HydrophobicContact CD2-CG 4.28Å; L40-E276 HydrophobicContact CD1-CG 3.82Å; L40-I280 HydrophobicContact CD1-CG2 4.42Å; L40-I280 HydrophobicContact CD2-CG2 3.66Å
41	Y	88.4	Confident	85.1	Confident	34 Å²	34	72.6 Å²	72.6	13%	0.133	39%	0.388	C	S	.	.	B	Isolated β-bridge	trans	-128.5	149.7	-171.8	-61.7	-70.1	0	0	0	110.3	R48 R49 L56 T274 E276	Y41-R48 VanDerWaalsContact CD1-C 3.5Å; Y41-R48 HydrophobicContact CD1-CB 3.95Å; Y41-R48 WeakPolarHBondContact CD1-O 3.5Å; Y41-R48 HydrophobicContact CE1-CB 4.17Å; Y41-R48 VanDerWaalsContact CE1-O 3.31Å; Y41-R48 WeakPolarHBondContact CE1-O 3.36Å; Y41-R48 HydrophobicContact CG-CB 4.36Å; Y41-R49 WeakPolarHBondContact CA-O 3.48Å; Y41-L56 HydrophobicContact CE1-CD1 3.98Å; Y41-L56 HydrophobicContact CE2-CD1 4.11Å; Y41-L56 WeakPolarHBondContact OH-CD1 3.46Å; Y41-T274 PolarHBondContact OH-OG1 3.18Å; Y41-T274 VanDerWaalsContact OH-OG1 3.1Å; Y41-E276 PolarHBondContact OH-OE1 3.44Å
42	A	81.7	Confident	84.9	Confident	28 Å²	28	75.7 Å²	75.7	23%	0.231	40%	0.404	C	S	.	.			trans	-65.8	134	170.8	0	0	0	0	0	110.6	R49 L51	A42-R49 PolarHBondContact N-O 3.2Å; A42-R49 VanDerWaalsContact N-O 3.09Å; A42-L51 HydrophobicContact CB-CD2 3.78Å
43	E	74.8	Confident	84.8	Confident	169 Å²	169	75.5 Å²	75.5	79%	0.79	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	146.6	173.2	-66.1	-175.7	163.6	0	0	110.8	Q45	E43-Q45 VanDerWaalsContact C-N 3.34Å; E43-Q45 PolarHBondContact O-N 2.95Å
44	G	67.6	Low	84.7	Confident	91 Å²	91	75.2 Å²	75.2	94%	0.938	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	2.4	172.9	0	0	0	0	0	116.6
45	Q	62.2	Low	84.5	Confident	103 Å²	103	72.1 Å²	72.1	48%	0.481	38%	0.383	S	S	.	.			trans	-106.7	126.3	174.5	-68.1	-172.6	-8.5	0	0	112.1	E43 N47 R48	E43-Q45 VanDerWaalsContact C-N 3.34Å; E43-Q45 PolarHBondContact O-N 2.95Å; Q45-N47 PolarHBondContact O-N 2.92Å; Q45-N47 VanDerWaalsContact O-N 3.16Å; Q45-R48 PolarHBondContact O-N 3.13Å
46	S	63.7	Low	84.3	Confident	123 Å²	123	72.2 Å²	72.2	86%	0.86	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.5	176.2	50.6	0	0	0	0	113.3	R48	S46-R48 VanDerWaalsContact C-N 3.35Å; S46-R48 PolarHBondContact O-N 2.82Å
47	N	67.7	Low	84.3	Confident	134 Å²	134	67 Å²	67	72%	0.717	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	4.5	-173.1	-89.4	-3.5	0	0	0	116.2	Q45 R49	Q45-N47 PolarHBondContact O-N 2.92Å; Q45-N47 VanDerWaalsContact O-N 3.16Å; N47-R49 VanDerWaalsContact C-N 3.25Å; N47-R49 PolarHBondContact O-N 3.48Å
48	R	77.3	Confident	84.3	Confident	92 Å²	92	63.9 Å²	63.9	35%	0.347	35%	0.345	S	S	.	.			trans	41.1	56.6	-178.8	-64.6	-174.5	71.1	151.8	-1.6	111.4	Y41 Q45 S46 K64 T274	Y41-R48 VanDerWaalsContact CD1-C 3.5Å; Y41-R48 HydrophobicContact CD1-CB 3.95Å; Y41-R48 WeakPolarHBondContact CD1-O 3.5Å; Y41-R48 HydrophobicContact CE1-CB 4.17Å; Y41-R48 VanDerWaalsContact CE1-O 3.31Å; Y41-R48 WeakPolarHBondContact CE1-O 3.36Å; Y41-R48 HydrophobicContact CG-CB 4.36Å; Q45-R48 PolarHBondContact O-N 3.13Å; S46-R48 VanDerWaalsContact C-N 3.35Å; S46-R48 PolarHBondContact O-N 2.82Å; R48-K64 PolarHBondContact O-NZ 3.43Å; R48-K64 VanDerWaalsContact O-NZ 3.15Å; R48-T274 PolarHBondContact NH2-OG1 3.32Å
49	R	83	Confident	84.6	Confident	156 Å²	156	65 Å²	65	59%	0.589	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-74.7	131.3	178.1	-175	177.8	172.1	174.5	-3.1	108.9	Y41 A42 N47	Y41-R49 WeakPolarHBondContact CA-O 3.48Å; A42-R49 PolarHBondContact N-O 3.2Å; A42-R49 VanDerWaalsContact N-O 3.09Å; N47-R49 VanDerWaalsContact C-N 3.25Å; N47-R49 PolarHBondContact O-N 3.48Å
50	A	88.1	Confident	84.9	Confident	16 Å²	16	60.9 Å²	60.9	13%	0.132	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-63	145.2	175.2	0	0	0	0	0	110.5	L40 L56	L40-A50 WeakPolarHBondContact O-CA 3.36Å; A50-L56 HydrophobicContact CB-CB 3.84Å; A50-L56 WeakPolarHBondContact CB-O 3.44Å
51	L	90.5	Very high	85.2	Confident	32 Å²	32	60 Å²	60	17%	0.168	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-77.5	137.5	178	-73	174.6	0	0	0	111.8	K37 L39 L40 A42 Y53 G54	K37-L51 HydrophobicContact CD-CB 4.26Å; K37-L51 HydrophobicContact CD-CD1 4.28Å; L39-L51 HydrophobicContact CB-CD1 3.57Å; L40-L51 PolarHBondContact O-N 2.82Å; A42-L51 HydrophobicContact CB-CD2 3.78Å; L51-Y53 PolarHBondContact O-N 2.92Å; L51-G54 PolarHBondContact O-N 3.4Å
52	D	92.3	Very high	85.3	Confident	82 Å²	82	58.8 Å²	58.8	44%	0.439	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	134.4	167	-61.7	-23.6	0	0	0	109.7	K37 G54	K37-D52 WeakPolarHBondContact CD-O 3.42Å; K37-D52 WeakPolarHBondContact CE-O 3.25Å; K37-D52 PolarHBondContact NZ-O 3.42Å; D52-G54 PolarHBondContact O-N 2.83Å
53	Y	95.7	Very high	85.3	Confident	104 Å²	104	58.8 Å²	58.8	41%	0.408	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	23.5	-172.9	-54	-88	0	0	0	113.7	Q34 L36 K37 L51 D57	Q34-Y53 WeakPolarHBondContact O-CD1 3.4Å; L36-Y53 PolarHBondContact N-O 2.84Å; K37-Y53 PolarHBondContact N-O 2.98Å; L51-Y53 PolarHBondContact O-N 2.92Å; Y53-D57 PolarHBondContact N-OD2 3.27Å
54	G	94.6	Very high	85.7	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	-98.9	-177	170.8	0	0	0	0	0	113.2	L51 D52 L56 D57	L51-G54 PolarHBondContact O-N 3.4Å; D52-G54 PolarHBondContact O-N 2.83Å; G54-L56 VanDerWaalsContact C-N 3.3Å; G54-L56 PolarHBondContact O-N 2.86Å; G54-D57 WeakPolarHBondContact O-CB 3.21Å; G54-D57 PolarHBondContact O-N 2.78Å
55	L	94.5	Very high	86.3	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.5	-177.7	-69.3	167.6	0	0	0	114.8	V35 L40 L60 V257 I280 Y283 Q284 L287	V35-L55 HydrophobicContact CG1-CD2 3.91Å; V35-L55 HydrophobicContact CG1-CG 4.14Å; L40-L55 HydrophobicContact CD2-CB 3.89Å; L40-L55 HydrophobicContact CD2-CD1 4.02Å; L55-L60 WeakPolarHBondContact O-CD1 3.31Å; L55-V257 HydrophobicContact CD2-CG1 4Å; L55-V257 HydrophobicContact CD2-CG2 4.26Å; L55-I280 HydrophobicContact CB-CG2 4.29Å; L55-I280 HydrophobicContact CD1-CG2 4.48Å; L55-Y283 HydrophobicContact CD2-CD2 4.43Å; L55-Y283 HydrophobicContact CD2-CG 4.19Å; L55-Q284 HydrophobicContact CD1-CB 3.81Å; L55-L287 HydrophobicContact CD1-CD1 4.1Å; L55-L287 HydrophobicContact CD2-CD1 3.89Å; L55-L287 HydrophobicContact CG-CD1 3.98Å
56	L	93.2	Very high	87.4	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.016	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	19	178.2	-60.4	179.9	0	0	0	112	L40 Y41 A50 G54 N63 I280	L40-L56 HydrophobicContact CB-CD1 4.12Å; L40-L56 HydrophobicContact CD2-CD1 4.42Å; L40-L56 HydrophobicContact CD2-CG 4.28Å; Y41-L56 HydrophobicContact CE1-CD1 3.98Å; Y41-L56 HydrophobicContact CE2-CD1 4.11Å; Y41-L56 WeakPolarHBondContact OH-CD1 3.46Å; A50-L56 HydrophobicContact CB-CB 3.84Å; A50-L56 WeakPolarHBondContact CB-O 3.44Å; G54-L56 VanDerWaalsContact C-N 3.3Å; G54-L56 PolarHBondContact O-N 2.86Å; L56-N63 PolarHBondContact O-ND2 2.79Å; L56-I280 HydrophobicContact CD2-CD1 4.29Å; L56-I280 HydrophobicContact CD2-CG1 4.36Å; L56-I280 HydrophobicContact CD2-CG2 4.16Å
57	D	94.3	Very high	88.4	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.011	27%	0.271	C	S	.	.			trans	-55.8	131.4	-179.1	-172.4	-55.6	0	0	0	110.9	I33 Y53 G54 R59 L60	I33-D57 HydrophobicContact CD1-CB 3.58Å; Y53-D57 PolarHBondContact N-OD2 3.27Å; G54-D57 WeakPolarHBondContact O-CB 3.21Å; G54-D57 PolarHBondContact O-N 2.78Å; D57-R59 PolarHBondContact O-N 2.88Å; D57-R59 VanDerWaalsContact OD1-CB 3.25Å; D57-R59 WeakPolarHBondContact OD1-CB 3.41Å; D57-R59 WeakPolarHBondContact OD1-CG 3.37Å; D57-R59 IonicContact OD1-CZ 3.77Å; D57-R59 PolarHBondContact OD1-N 3.43Å; D57-R59 IonicContact OD1-NE 2.96Å; D57-R59 PolarHBondContact OD1-NE 3.21Å; D57-R59 IonicContact OD1-NH2 3.38Å; D57-R59 IonicContact OD2-CZ 3.63Å; D57-R59 IonicContact OD2-NE 3.25Å; D57-R59 PolarHBondContact OD2-NE 2.93Å; D57-R59 IonicContact OD2-NH2 3.7Å; D57-R59 PolarHBondContact OD2-NH2 3Å; D57-L60 WeakPolarHBondContact O-CB 3.29Å; D57-L60 PolarHBondContact O-N 2.93Å
58	P	93.8	Very high	89.6	Confident	23 Å²	23	58.1 Å²	58.1	15%	0.149	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-60	-16.4	-177.1	-24.4	34.5	0	0	0	114.7	L60 G61 E67 C69 A70	P58-L60 PolarHBondContact O-N 3.09Å; P58-G61 PolarHBondContact O-N 3.17Å; P58-E67 VanDerWaalsContact CG-OE1 3.26Å; P58-E67 WeakPolarHBondContact CG-OE1 3.15Å; P58-C69 PolarHBondContact O-SG 3.09Å; P58-C69 VanDerWaalsContact O-SG 3.37Å; P58-A70 HydrophobicContact CB-CB 4.04Å; P58-A70 PolarHBondContact O-N 3.08Å
59	R	95.9	Very high	90.4	Very high	63 Å²	63	53.9 Å²	53.9	24%	0.238	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-69.3	-19.7	172.4	-67.2	173.7	-74.7	-179.2	0.8	112.8	I33 D57 G61 A70 T71 H82	I33-R59 HydrophobicContact CG2-CB 3.54Å; I33-R59 HydrophobicContact CG2-CG 4.16Å; D57-R59 PolarHBondContact O-N 2.88Å; D57-R59 VanDerWaalsContact OD1-CB 3.25Å; D57-R59 WeakPolarHBondContact OD1-CB 3.41Å; D57-R59 WeakPolarHBondContact OD1-CG 3.37Å; D57-R59 IonicContact OD1-CZ 3.77Å; D57-R59 PolarHBondContact OD1-N 3.43Å; D57-R59 IonicContact OD1-NE 2.96Å; D57-R59 PolarHBondContact OD1-NE 3.21Å; D57-R59 IonicContact OD1-NH2 3.38Å; D57-R59 IonicContact OD2-CZ 3.63Å; D57-R59 IonicContact OD2-NE 3.25Å; D57-R59 PolarHBondContact OD2-NE 2.93Å; D57-R59 IonicContact OD2-NH2 3.7Å; D57-R59 PolarHBondContact OD2-NH2 3Å; R59-G61 VanDerWaalsContact C-N 3.33Å; R59-A70 HydrophobicContact CG-CB 3.72Å; R59-T71 WeakPolarHBondContact CA-OG1 3.34Å; R59-T71 PolarHBondContact O-OG1 3.36Å; R59-H82 VanDerWaalsContact O-CB 3.24Å; R59-H82 WeakPolarHBondContact O-CB 3.47Å
60	L	96.3	Very high	91	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-80.8	-13.4	173.6	-62	175.6	0	0	0	113.1	I33 L55 D57 P58 H82 V257 S260	I33-L60 HydrophobicContact CD1-CD1 3.98Å; I33-L60 HydrophobicContact CD1-CD2 3.72Å; I33-L60 HydrophobicContact CD1-CG 3.6Å; I33-L60 HydrophobicContact CG1-CD2 3.64Å; I33-L60 HydrophobicContact CG1-CG 4.12Å; L55-L60 WeakPolarHBondContact O-CD1 3.31Å; D57-L60 WeakPolarHBondContact O-CB 3.29Å; D57-L60 PolarHBondContact O-N 2.93Å; P58-L60 PolarHBondContact O-N 3.09Å; L60-H82 WeakPolarHBondContact CA-O 3.08Å; L60-H82 WeakPolarHBondContact CD2-O 3.28Å; L60-H82 PolarHBondContact O-N 3.44Å; L60-V257 HydrophobicContact CD1-CG1 4.13Å; L60-S260 PolarHBondContact O-N 3.34Å
61	G	94.8	Very high	91.4	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.01	26%	0.257	C	S	.	.			trans	139.5	165.1	-179.6	0	0	0	0	0	112.3	P58 R59 N63 S260	P58-G61 PolarHBondContact O-N 3.17Å; R59-G61 VanDerWaalsContact C-N 3.33Å; G61-N63 PolarHBondContact O-N 3.32Å; G61-S260 PolarHBondContact O-OG 3.16Å
62	A	90.4	Very high	91.6	Very high	10 Å²	10	52.1 Å²	52.1	8%	0.083	26%	0.264	C	S	.	.			trans	-74.9	121.7	172.6	0	0	0	0	0	110.2	E67 C69	A62-E67 WeakPolarHBondContact CB-O 3.14Å; A62-C69 HydrophobicContact CB-CB 4.44Å
63	N	81.5	Confident	91.7	Very high	28 Å²	28	50.4 Å²	50.4	15%	0.15	27%	0.266	C	S	.	.			trans	-93.6	-28.9	178.1	-77	-47.6	0	0	0	112.7	L56 G61 S260	L56-N63 PolarHBondContact O-ND2 2.79Å; G61-N63 PolarHBondContact O-N 3.32Å; N63-S260 PolarHBondContact ND2-OG 3.24Å; N63-S260 WeakPolarHBondContact OD1-CB 3.22Å; N63-S260 PolarHBondContact OD1-OG 2.89Å
64	K	81.8	Confident	91.6	Very high	86 Å²	86	48.9 Å²	48.9	37%	0.374	26%	0.264	S	S	.	.	S	Bend	trans	-114	158.5	-174.6	-61.3	177	-174	173.5	0	110.6	R48 D66 E67	R48-K64 PolarHBondContact O-NZ 3.43Å; R48-K64 VanDerWaalsContact O-NZ 3.15Å; K64-D66 VanDerWaalsContact C-N 3.28Å; K64-D66 PolarHBondContact O-N 3.22Å; K64-E67 HydrophobicContact CB-CB 4.09Å; K64-E67 PolarHBondContact O-N 3.35Å
65	R	81.7	Confident	91.5	Very high	192 Å²	192	51.1 Å²	51.1	73%	0.725	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-35.1	179.7	-66.2	-170.7	179.1	173.3	1.3	113	E67 Y76	R65-E67 VanDerWaalsContact C-N 3.33Å; R65-Y76 HydrophobicContact CB-CD1 4.38Å; R65-Y76 HydrophobicContact CB-CE1 4.05Å; R65-Y76 HydrophobicContact CG-CD1 4.24Å; R65-Y76 HydrophobicContact CG-CE1 3.68Å
66	D	84.3	Confident	91.1	Very high	168 Å²	168	55.7 Å²	55.7	90%	0.898	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	15.3	-174.2	-47	-37	0	0	0	112.4	K64	K64-D66 VanDerWaalsContact C-N 3.28Å; K64-D66 PolarHBondContact O-N 3.22Å
67	E	85.7	Confident	90.9	Very high	48 Å²	48	62.4 Å²	62.4	22%	0.224	33%	0.325	C	S	.	.			trans	-117.7	141.1	-178.4	-177.4	172.3	-147.7	0	0	110.4	P58 A62 K64 R65	P58-E67 VanDerWaalsContact CG-OE1 3.26Å; P58-E67 WeakPolarHBondContact CG-OE1 3.15Å; A62-E67 WeakPolarHBondContact CB-O 3.14Å; K64-E67 HydrophobicContact CB-CB 4.09Å; K64-E67 PolarHBondContact O-N 3.35Å; R65-E67 VanDerWaalsContact C-N 3.33Å
68	L	92.4	Very high	90.8	Very high	112 Å²	112	67.5 Å²	67.5	59%	0.586	35%	0.347	S	S	*	.			trans	-102.5	144.3	172.2	-61.6	178.2	0	0	0	109.6	A70 D75	L68-A70 PolarHBondContact O-N 2.94Å; L68-D75 HydrophobicContact CD2-CB 4.12Å
69	C	94.5	Very high	90.8	Very high	2 Å²	2	67.1 Å²	67.1	1%	0.014	35%	0.345	C	S	.	.			trans	-64.3	129.4	173.9	177.2	0	0	0	0	110.3	P58 A62 T71 G73 L74 C79 H82	P58-C69 PolarHBondContact O-SG 3.09Å; P58-C69 VanDerWaalsContact O-SG 3.37Å; A62-C69 HydrophobicContact CB-CB 4.44Å; C69-T71 PolarHBondContact O-N 2.77Å; C69-T71 PolarHBondContact SG-N 2.98Å; C69-T71 VanDerWaalsContact SG-N 3.35Å; C69-G73 WeakPolarHBondContact O-CA 3.3Å; C69-G73 PolarHBondContact O-N 3.45Å; C69-L74 WeakPolarHBondContact CB-O 3.5Å; C69-L74 PolarHBondContact N-O 3.27Å; C69-C79 HydrophobicContact CB-CB 4.43Å; C69-H82 PolarHBondContact SG-CD2 2.94Å
70	A	95.5	Very high	90.7	Very high	71 Å²	71	71.3 Å²	71.3	59%	0.587	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-12	179.3	0	0	0	0	0	113.8	P58 R59 L68	P58-A70 HydrophobicContact CB-CB 4.04Å; P58-A70 PolarHBondContact O-N 3.08Å; R59-A70 HydrophobicContact CG-CB 3.72Å; L68-A70 PolarHBondContact O-N 2.94Å
71	T	96.3	Very high	90.7	Very high	48 Å²	48	71.7 Å²	71.7	29%	0.294	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-50.2	-179.9	-59.5	0	0	0	0	112.5	H32 R59 C69 H82	H32-T71 WeakPolarHBondContact CE1-CG2 3.36Å; H32-T71 VanDerWaalsContact ND1-CG2 3.35Å; H32-T71 WeakPolarHBondContact ND1-CG2 3.39Å; R59-T71 WeakPolarHBondContact CA-OG1 3.34Å; R59-T71 PolarHBondContact O-OG1 3.36Å; C69-T71 PolarHBondContact O-N 2.77Å; C69-T71 PolarHBondContact SG-N 2.98Å; C69-T71 VanDerWaalsContact SG-N 3.35Å; T71-H82 WeakPolarHBondContact CG2-ND1 3.4Å
72	C	95.4	Very high	90.8	Very high	49 Å²	49	72.5 Å²	72.5	33%	0.331	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-7.8	-178.1	59.6	0	0	0	0	114.5	L74 H82	C72-L74 HydrophobicContact CB-CD1 4.33Å; C72-L74 HydrophobicContact CB-CG 4.23Å; C72-L74 PolarHBondContact O-N 2.92Å; C72-H82 PolarHBondContact SG-NE2 3.14Å
73	G	94.4	Very high	91.1	Very high	45 Å²	45	77.1 Å²	77.1	46%	0.464	39%	0.393	S	S	.	.			trans	69.7	6.3	-177.1	0	0	0	0	0	114.6	C69	C69-G73 WeakPolarHBondContact O-CA 3.3Å; C69-G73 PolarHBondContact O-N 3.45Å
74	L	92.9	Very high	91.9	Very high	73 Å²	73	75.8 Å²	75.8	38%	0.382	39%	0.386	S	S	.	.			trans	-93	154	-177.8	-58.4	176.8	0	0	0	111.8	C69 C72 K78 C79	C69-L74 WeakPolarHBondContact CB-O 3.5Å; C69-L74 PolarHBondContact N-O 3.27Å; C72-L74 HydrophobicContact CB-CD1 4.33Å; C72-L74 HydrophobicContact CB-CG 4.23Å; C72-L74 PolarHBondContact O-N 2.92Å; L74-K78 HydrophobicContact CB-CB 4.08Å; L74-K78 HydrophobicContact CD1-CB 4.2Å; L74-K78 HydrophobicContact CD2-CB 4.49Å; L74-K78 HydrophobicContact CG-CB 4.49Å; L74-C79 HydrophobicContact CB-CB 4.2Å
75	D	91.3	Very high	92.7	Very high	47 Å²	47	72.3 Å²	72.3	25%	0.251	37%	0.371	S	S	.	.			trans	-71.5	175.6	173.4	66	32.6	0	0	0	112.8	L68 Q77 K78 C79	L68-D75 HydrophobicContact CD2-CB 4.12Å; D75-Q77 PolarHBondContact O-N 3.3Å; D75-Q77 WeakPolarHBondContact OD1-CA 3.46Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.47Å; D75-Q77 PolarHBondContact OD1-N 3.23Å; D75-K78 PolarHBondContact O-N 3.1Å; D75-K78 PolarHBondContact OD1-N 3.48Å; D75-C79 WeakPolarHBondContact O-CB 3.14Å; D75-C79 PolarHBondContact O-N 3.26Å
76	Y	87.9	Confident	93.4	Very high	98 Å²	98	63.2 Å²	63.2	38%	0.384	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.2	-178.9	82.6	-82.7	0	0	0	114.9	R65	R65-Y76 HydrophobicContact CB-CD1 4.38Å; R65-Y76 HydrophobicContact CB-CE1 4.05Å; R65-Y76 HydrophobicContact CG-CD1 4.24Å; R65-Y76 HydrophobicContact CG-CE1 3.68Å
77	Q	89	Confident	94	Very high	143 Å²	143	58 Å²	58	67%	0.668	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-35.4	178.9	-62.6	-172.6	-5.3	0	0	111.7	D75	D75-Q77 PolarHBondContact O-N 3.3Å; D75-Q77 WeakPolarHBondContact OD1-CA 3.46Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.47Å; D75-Q77 PolarHBondContact OD1-N 3.23Å
78	K	91	Very high	94.4	Very high	110 Å²	110	56 Å²	56	48%	0.478	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-27.7	-176.5	-64.8	-178.9	-178.2	-180	0	113.1	L74 D75 I80	L74-K78 HydrophobicContact CB-CB 4.08Å; L74-K78 HydrophobicContact CD1-CB 4.2Å; L74-K78 HydrophobicContact CD2-CB 4.49Å; L74-K78 HydrophobicContact CG-CB 4.49Å; D75-K78 PolarHBondContact O-N 3.1Å; D75-K78 PolarHBondContact OD1-N 3.48Å; K78-I80 PolarHBondContact O-N 3.22Å
79	C	93.4	Very high	94.5	Very high	14 Å²	14	52.6 Å²	52.6	10%	0.095	28%	0.284	C	S	.	.			trans	-64.9	124.7	178.3	-177.4	0	0	0	0	110.7	C69 L74 D75 G81	C69-C79 HydrophobicContact CB-CB 4.43Å; L74-C79 HydrophobicContact CB-CB 4.2Å; D75-C79 WeakPolarHBondContact O-CB 3.14Å; D75-C79 PolarHBondContact O-N 3.26Å; C79-G81 PolarHBondContact O-N 3.27Å; C79-G81 PolarHBondContact SG-N 3.49Å
80	I	94.4	Very high	94.4	Very high	152 Å²	152	54.5 Å²	54.5	78%	0.779	30%	0.296	S	S	*	.			trans	-75.6	-15.1	174.6	60.5	164.7	0	0	0	113.1	K78	K78-I80 PolarHBondContact O-N 3.22Å
81	G	95.3	Very high	94.4	Very high	8 Å²	8	52.1 Å²	52.1	8%	0.082	27%	0.274	C	S	.	.			trans	85.9	154.3	-173	0	0	0	0	0	113.7	C79	C79-G81 PolarHBondContact O-N 3.27Å; C79-G81 PolarHBondContact SG-N 3.49Å
82	H	97.3	Very high	94.3	Very high	18 Å²	18	49.9 Å²	49.9	8%	0.083	26%	0.26	C	S	.	.			trans	-129.5	138.5	-174.2	-59.5	-78	0	0	0	110.8	H32 R59 L60 C69 T71 C72 P259	H32-H82 HydrophobicContact CB-CB 4.48Å; H32-H82 AromaticContact CD2-CG 3.9Å; H32-H82 AromaticContact CD2-ND1 3.62Å; H32-H82 AromaticContact NE2-ND1 3.36Å; H32-H82 PolarHBondContact NE2-ND1 3.44Å; R59-H82 VanDerWaalsContact O-CB 3.24Å; R59-H82 WeakPolarHBondContact O-CB 3.47Å; L60-H82 WeakPolarHBondContact CA-O 3.08Å; L60-H82 WeakPolarHBondContact CD2-O 3.28Å; L60-H82 PolarHBondContact O-N 3.44Å; C69-H82 PolarHBondContact SG-CD2 2.94Å; T71-H82 WeakPolarHBondContact CG2-ND1 3.4Å; C72-H82 PolarHBondContact SG-NE2 3.14Å; H82-P259 WeakPolarHBondContact O-CA 3.32Å
83	W	97.7	Very high	94.2	Very high	107 Å²	107	47.8 Å²	47.8	41%	0.405	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	149.9	-178	-69.9	84.8	0	0	0	111.5	S31 H32 P256 C258 P259	S31-W83 CarbonylContact C-O 3.54Å; S31-W83 VanDerWaalsContact CA-O 3.3Å; S31-W83 WeakPolarHBondContact CA-O 3.39Å; H32-W83 PolarHBondContact N-O 3.26Å; W83-P256 HydrophobicContact CE3-CB 4.12Å; W83-P256 HydrophobicContact CZ3-CB 4.05Å; W83-C258 HydrophobicContact CZ3-CB 4.2Å; W83-P259 HydrophobicContact CD2-CG 4.24Å; W83-P259 HydrophobicContact CG-CG 4.24Å
84	G	97.6	Very high	94.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	179.2	163.9	0	0	0	0	0	110.7	S31 I33 V257	S31-G84 PolarHBondContact OG-O 2.73Å; I33-G84 VanDerWaalsContact O-CA 3.27Å; I33-G84 WeakPolarHBondContact O-CA 3.21Å; G84-V257 PolarHBondContact N-O 3.47Å; G84-V257 PolarHBondContact O-N 3.13Å
85	Y	97.9	Very high	94.1	Very high	13 Å²	13	44.6 Å²	44.6	5%	0.051	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	165	167.4	72.7	-86.4	0	0	0	111.1	K28 S31 I33 Q34 V35 R254 V255	K28-Y85 HydrophobicContact CB-CE1 4.43Å; K28-Y85 HydrophobicContact CG-CE1 4.03Å; S31-Y85 VanDerWaalsContact CB-CD1 3.45Å; I33-Y85 PolarHBondContact O-N 2.98Å; I33-Y85 VanDerWaalsContact O-N 3.08Å; Q34-Y85 CarbonylContact C-O 3.54Å; Q34-Y85 VanDerWaalsContact CA-O 3.31Å; Q34-Y85 WeakPolarHBondContact CA-O 3.47Å; Q34-Y85 HydrophobicContact CB-CE1 4.08Å; Q34-Y85 HydrophobicContact CB-CE2 4.05Å; Q34-Y85 HydrophobicContact CG-CD2 4.22Å; Q34-Y85 HydrophobicContact CG-CE2 3.65Å; Q34-Y85 PolarHBondContact OE1-OH 3.47Å; V35-Y85 PolarHBondContact N-O 2.95Å; Y85-R254 HydrophobicContact CD2-CG 3.58Å; Y85-R254 HydrophobicContact CE2-CG 4.47Å; Y85-R254 VanDerWaalsContact CE2-NE 3.3Å; Y85-R254 HydrophobicContact CG-CG 3.96Å; Y85-V255 CarbonylContact C-O 3.6Å; Y85-V255 VanDerWaalsContact CA-O 3.24Å; Y85-V255 WeakPolarHBondContact CA-O 3.31Å
86	F	97.1	Very high	94	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.2	158.6	58.1	-95.9	0	0	0	110	V35 L88 R254 V255 V257 Y283 I286 L287	V35-F86 HydrophobicContact CB-CB 4.44Å; V35-F86 VanDerWaalsContact O-CB 3.26Å; V35-F86 WeakPolarHBondContact O-CB 3.23Å; F86-L88 HydrophobicContact CD2-CD2 4.19Å; F86-L88 HydrophobicContact CE2-CD2 3.77Å; F86-R254 WeakPolarHBondContact O-CA 3.19Å; F86-V255 HydrophobicContact CD1-CB 4.44Å; F86-V255 HydrophobicContact CD2-CB 4.06Å; F86-V255 HydrophobicContact CD2-CG2 4.42Å; F86-V255 HydrophobicContact CE1-CB 3.97Å; F86-V255 HydrophobicContact CE1-CG1 3.84Å; F86-V255 HydrophobicContact CE2-CB 3.54Å; F86-V255 HydrophobicContact CE2-CG1 4.06Å; F86-V255 HydrophobicContact CE2-CG2 3.73Å; F86-V255 HydrophobicContact CG-CB 4.48Å; F86-V255 HydrophobicContact CZ-CB 3.5Å; F86-V255 HydrophobicContact CZ-CG1 3.48Å; F86-V255 VanDerWaalsContact CZ-CG1 3.48Å; F86-V255 HydrophobicContact CZ-CG2 4.02Å; F86-V255 PolarHBondContact N-O 2.98Å; F86-V255 PolarHBondContact O-N 3.19Å; F86-V257 HydrophobicContact CD1-CG2 3.41Å; F86-V257 VanDerWaalsContact CD1-CG2 3.41Å; F86-V257 HydrophobicContact CE1-CG2 3.69Å; F86-Y283 AromaticContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CG 4.46Å; F86-Y283 HydrophobicContact CZ-CD1 4.18Å; F86-I286 HydrophobicContact CE2-CB 4.46Å; F86-I286 HydrophobicContact CE2-CG2 3.57Å; F86-I286 HydrophobicContact CZ-CB 4.15Å; F86-I286 HydrophobicContact CZ-CG2 3.66Å; F86-L287 HydrophobicContact CB-CD2 3.76Å; F86-L287 HydrophobicContact CD1-CD1 4.31Å; F86-L287 HydrophobicContact CD1-CD2 3.89Å; F86-L287 HydrophobicContact CD1-CG 4.09Å; F86-L287 HydrophobicContact CD2-CD2 3.61Å; F86-L287 HydrophobicContact CD2-CG 4.27Å; F86-L287 HydrophobicContact CE1-CD1 4.5Å; F86-L287 HydrophobicContact CE1-CD2 4.38Å; F86-L287 HydrophobicContact CE1-CG 4.15Å; F86-L287 HydrophobicContact CE2-CD2 4.11Å; F86-L287 HydrophobicContact CE2-CG 4.31Å; F86-L287 HydrophobicContact CG-CD2 3.49Å; F86-L287 VanDerWaalsContact CG-CD2 3.49Å; F86-L287 HydrophobicContact CG-CG 4.16Å; F86-L287 HydrophobicContact CZ-CD2 4.47Å; F86-L287 HydrophobicContact CZ-CG 4.25Å
87	D	96.4	Very high	94.3	Very high	59 Å²	59	43.9 Å²	43.9	32%	0.316	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	140	178	-70.4	-29.9	0	0	0	109.1	R254	D87-R254 WeakPolarHBondContact OD1-CB 3.3Å; D87-R254 WeakPolarHBondContact OD1-CG 3.31Å; D87-R254 IonicContact OD1-CZ 3.59Å; D87-R254 VanDerWaalsContact OD1-CZ 3.22Å; D87-R254 IonicContact OD1-NE 3.7Å; D87-R254 PolarHBondContact OD1-NE 3.35Å; D87-R254 IonicContact OD1-NH2 3.05Å; D87-R254 PolarHBondContact OD1-NH2 2.94Å; D87-R254 IonicContact OD2-CZ 2.55Å; D87-R254 IonicContact OD2-NE 3.81Å; D87-R254 IonicContact OD2-NH2 3.21Å; D87-R254 PolarHBondContact OD2-NH2 3.39Å
88	L	95.7	Very high	94.4	Very high	6 Å²	6	37.4 Å²	37.4	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	141	172.4	-62.9	176	0	0	0	108.9	F86 T90 I92 V252 Q253 V255 I286 A290 L309	F86-L88 HydrophobicContact CD2-CD2 4.19Å; F86-L88 HydrophobicContact CE2-CD2 3.77Å; L88-T90 WeakPolarHBondContact CB-O 3.49Å; L88-T90 PolarHBondContact O-N 2.78Å; L88-I92 HydrophobicContact CD1-CD1 3.51Å; L88-I92 HydrophobicContact CD1-CG1 3.64Å; L88-I92 HydrophobicContact CD1-CG2 4.31Å; L88-V252 HydrophobicContact CD1-CG1 4.3Å; L88-Q253 PolarHBondContact N-O 2.82Å; L88-V255 HydrophobicContact CD1-CG2 3.77Å; L88-V255 HydrophobicContact CD2-CG2 4.14Å; L88-V255 HydrophobicContact CG-CG2 3.89Å; L88-I286 HydrophobicContact CD2-CG2 3.91Å; L88-A290 HydrophobicContact CD2-CB 4.3Å; L88-L309 HydrophobicContact CD2-CD1 4.1Å; L88-L309 HydrophobicContact CD2-CD2 4.31Å
89	P	93.5	Very high	94.4	Very high	40 Å²	40	39.6 Å²	39.6	26%	0.26	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	-27.9	178.3	27.4	-36.6	0	0	0	111.9	A290 I293 E294	P89-A290 HydrophobicContact CG-CB 4.26Å; P89-I293 HydrophobicContact CB-CG2 4.25Å; P89-I293 HydrophobicContact CG-CB 3.95Å; P89-I293 HydrophobicContact CG-CG2 3.81Å; P89-E294 HydrophobicContact CB-CG 3.58Å; P89-E294 HydrophobicContact CG-CG 4.09Å
90	T	92.4	Very high	94.5	Very high	43 Å²	43	43.2 Å²	43.2	26%	0.264	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.3	176.3	57.5	0	0	0	0	110.6	L88 I293 L306	L88-T90 WeakPolarHBondContact CB-O 3.49Å; L88-T90 PolarHBondContact O-N 2.78Å; T90-I293 HydrophobicContact CG2-CG2 4.22Å; T90-L306 WeakPolarHBondContact OG1-CD1 3.07Å
91	P	94.8	Very high	94.6	Very high	21 Å²	21	36 Å²	36	14%	0.136	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	148.1	177.5	26.5	-32.6	0	0	0	111.1	P217 M221 I251 V252	P91-P217 HydrophobicContact CB-CB 4.3Å; P91-P217 HydrophobicContact CG-CB 4.43Å; P91-P217 VanDerWaalsContact O-CB 3.23Å; P91-P217 WeakPolarHBondContact O-CB 3.42Å; P91-P217 WeakPolarHBondContact O-CG 3.36Å; P91-M221 HydrophobicContact CB-SD 3.8Å; P91-M221 HydrophobicContact CG-SD 4.18Å; P91-I251 HydrophobicContact CB-CG2 3.64Å; P91-V252 WeakPolarHBondContact CA-O 3.25Å
92	I	94.9	Very high	94.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	155	177.4	65.4	174.1	0	0	0	111.7	L88 I251 V252 L306 L309 H310 F313	L88-I92 HydrophobicContact CD1-CD1 3.51Å; L88-I92 HydrophobicContact CD1-CG1 3.64Å; L88-I92 HydrophobicContact CD1-CG2 4.31Å; I92-I251 WeakPolarHBondContact O-CG2 3.42Å; I92-V252 HydrophobicContact CG1-CB 3.82Å; I92-V252 HydrophobicContact CG1-CG1 4.35Å; I92-V252 PolarHBondContact N-O 2.92Å; I92-V252 PolarHBondContact O-N 3.47Å; I92-L306 HydrophobicContact CG2-CD1 4.13Å; I92-L309 HydrophobicContact CG2-CD2 3.82Å; I92-L309 HydrophobicContact CG2-CG 4.17Å; I92-H310 VanDerWaalsContact CA-NE2 3.27Å; I92-H310 WeakPolarHBondContact CA-NE2 3.21Å; I92-H310 VanDerWaalsContact CB-NE2 3.3Å; I92-H310 WeakPolarHBondContact CB-NE2 3.49Å; I92-H310 VanDerWaalsContact CG2-CE1 3.47Å; I92-H310 WeakPolarHBondContact CG2-CE1 3.49Å; I92-F313 HydrophobicContact CD1-CB 3.41Å; I92-F313 VanDerWaalsContact CD1-CB 3.41Å; I92-F313 HydrophobicContact CD1-CD1 3.71Å; I92-F313 HydrophobicContact CD1-CD2 3.84Å; I92-F313 HydrophobicContact CD1-CE1 4.46Å; I92-F313 HydrophobicContact CD1-CG 3.35Å
93	Y	94.2	Very high	94.6	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.02	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	130.3	173.9	-72.2	-51	0	0	0	111.5	V95 I101 P173 V175 I215 P217 A220 I251 H310	Y93-V95 PolarHBondContact O-N 3.38Å; Y93-V95 VanDerWaalsContact O-N 3.16Å; Y93-I101 HydrophobicContact CD1-CD1 3.78Å; Y93-I101 HydrophobicContact CD1-CG2 3.94Å; Y93-I101 HydrophobicContact CE1-CG2 3.65Å; Y93-I101 HydrophobicContact CG-CD1 4.45Å; Y93-P173 WeakPolarHBondContact CD2-O 3.37Å; Y93-P173 WeakPolarHBondContact CE2-O 2.9Å; Y93-V175 HydrophobicContact CE2-CG2 3.84Å; Y93-I215 PolarHBondContact OH-O 3.37Å; Y93-P217 HydrophobicContact CD1-CB 4.24Å; Y93-P217 HydrophobicContact CD1-CG 4.34Å; Y93-P217 HydrophobicContact CD2-CG 3.76Å; Y93-P217 HydrophobicContact CE1-CB 4.17Å; Y93-P217 HydrophobicContact CE1-CG 4.37Å; Y93-P217 HydrophobicContact CE2-CB 4.43Å; Y93-P217 HydrophobicContact CE2-CG 3.79Å; Y93-P217 HydrophobicContact CG-CB 4.41Å; Y93-P217 HydrophobicContact CG-CG 4.05Å; Y93-A220 HydrophobicContact CE1-CB 3.73Å; Y93-A220 WeakPolarHBondContact OH-CB 3.25Å; Y93-I251 HydrophobicContact CD1-CD1 3.39Å; Y93-I251 HydrophobicContact CE1-CD1 3.5Å; Y93-I251 VanDerWaalsContact CE1-CD1 3.5Å; Y93-H310 PolarHBondContact N-NE2 2.64Å
94	H	93.8	Very high	94.6	Very high	35 Å²	35	32 Å²	32	16%	0.162	16%	0.164	C	C	.	.			trans	-67.2	117.6	168.5	-170.5	-81.5	0	0	0	110	G96 Y97 T98 L250 V252 F313	H94-G96 VanDerWaalsContact C-N 3.29Å; H94-G96 PolarHBondContact ND1-N 3Å; H94-G96 VanDerWaalsContact ND1-N 3.15Å; H94-G96 PolarHBondContact O-N 3.36Å; H94-Y97 HydrophobicContact CB-CD2 3.66Å; H94-Y97 HydrophobicContact CB-CE2 4.48Å; H94-Y97 HydrophobicContact CB-CG 4.4Å; H94-Y97 AromaticContact CE1-CD2 3.86Å; H94-Y97 AromaticContact CE1-CE2 3.74Å; H94-Y97 AromaticContact CG-CD2 3.4Å; H94-Y97 AromaticContact CG-CE2 3.83Å; H94-Y97 AromaticContact ND1-CD2 3.17Å; H94-Y97 WeakPolarHBondContact ND1-CD2 3.33Å; H94-Y97 AromaticContact ND1-CE2 3.53Å; H94-Y97 AromaticContact ND1-CG 3.71Å; H94-Y97 CarbonylContact O-C 3.53Å; H94-Y97 PolarHBondContact O-N 3.32Å; H94-T98 PolarHBondContact O-N 3.04Å; H94-T98 VanDerWaalsContact O-N 3.11Å; H94-T98 PolarHBondContact O-OG1 3.36Å; H94-L250 WeakPolarHBondContact CB-O 3.4Å; H94-L250 PolarHBondContact N-O 2.97Å; H94-V252 HydrophobicContact CB-CG2 3.73Å; H94-F313 AromaticContact CD2-CE1 3.9Å; H94-F313 AromaticContact CD2-CZ 3.99Å
95	V	90	Very high	94.6	Very high	16 Å²	16	32 Å²	32	10%	0.097	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-62.1	-35.3	-171	78.8	0	0	0	0	113.7	Y93 Y97 T98 L172 A314 I317	Y93-V95 PolarHBondContact O-N 3.38Å; Y93-V95 VanDerWaalsContact O-N 3.16Å; V95-Y97 PolarHBondContact O-N 3.48Å; V95-T98 PolarHBondContact O-OG1 2.97Å; V95-L172 HydrophobicContact CG2-CD2 4.47Å; V95-A314 HydrophobicContact CB-CB 4.1Å; V95-A314 HydrophobicContact CG1-CB 4.34Å; V95-A314 HydrophobicContact CG2-CB 3.83Å; V95-I317 HydrophobicContact CG1-CB 3.6Å; V95-I317 HydrophobicContact CG1-CG1 3.93Å; V95-I317 HydrophobicContact CG1-CG2 3.74Å
96	G	90.3	Very high	94.6	Very high	48 Å²	48	33.5 Å²	33.5	50%	0.495	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-70.2	-16.3	176.1	0	0	0	0	0	113.6	H94	H94-G96 VanDerWaalsContact C-N 3.29Å; H94-G96 PolarHBondContact ND1-N 3Å; H94-G96 VanDerWaalsContact ND1-N 3.15Å; H94-G96 PolarHBondContact O-N 3.36Å
97	Y	93.1	Very high	94.6	Very high	82 Å²	82	33.4 Å²	33.4	32%	0.322	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-114.2	1.7	-177	-57.8	-48.5	0	0	0	113.7	L21 H94 V95 W99 H100 I101 L250	L21-Y97 HydrophobicContact CD2-CD2 4.35Å; L21-Y97 HydrophobicContact CD2-CE1 4.37Å; L21-Y97 HydrophobicContact CD2-CE2 3.6Å; H94-Y97 HydrophobicContact CB-CD2 3.66Å; H94-Y97 HydrophobicContact CB-CE2 4.48Å; H94-Y97 HydrophobicContact CB-CG 4.4Å; H94-Y97 AromaticContact CE1-CD2 3.86Å; H94-Y97 AromaticContact CE1-CE2 3.74Å; H94-Y97 AromaticContact CG-CD2 3.4Å; H94-Y97 AromaticContact CG-CE2 3.83Å; H94-Y97 AromaticContact ND1-CD2 3.17Å; H94-Y97 WeakPolarHBondContact ND1-CD2 3.33Å; H94-Y97 AromaticContact ND1-CE2 3.53Å; H94-Y97 AromaticContact ND1-CG 3.71Å; H94-Y97 CarbonylContact O-C 3.53Å; H94-Y97 PolarHBondContact O-N 3.32Å; V95-Y97 PolarHBondContact O-N 3.48Å; Y97-W99 PolarHBondContact O-N 3.23Å; Y97-W99 VanDerWaalsContact O-N 3.08Å; Y97-H100 WeakPolarHBondContact O-CA 3.22Å; Y97-H100 WeakPolarHBondContact O-CB 3.36Å; Y97-H100 PolarHBondContact O-N 2.87Å; Y97-I101 WeakPolarHBondContact O-CG1 3.32Å; Y97-I101 PolarHBondContact O-N 3.46Å; Y97-L250 HydrophobicContact CD1-CD2 4.26Å; Y97-L250 HydrophobicContact CD2-CD2 3.71Å; Y97-L250 HydrophobicContact CE2-CD2 4.37Å; Y97-L250 HydrophobicContact CG-CD2 3.68Å
98	T	91.6	Very high	94.7	Very high	7 Å²	7	30.6 Å²	30.6	4%	0.043	16%	0.156	C	C	.	.	H	α-helix	trans	-51.8	-39.9	-177.1	-51.3	0	0	0	0	112.4	H94 V95 I101 V102 K168	H94-T98 PolarHBondContact O-N 3.04Å; H94-T98 VanDerWaalsContact O-N 3.11Å; H94-T98 PolarHBondContact O-OG1 3.36Å; V95-T98 PolarHBondContact O-OG1 2.97Å; T98-I101 PolarHBondContact O-N 3.28Å; T98-V102 WeakPolarHBondContact O-CG2 3.36Å; T98-V102 PolarHBondContact O-N 2.9Å; T98-K168 HydrophobicContact CG2-CD 4.28Å; T98-K168 HydrophobicContact CG2-CG 4.39Å
99	W	91.6	Very high	94.8	Very high	156 Å²	156	30.3 Å²	30.3	59%	0.591	16%	0.155	S	C	*	.	H	α-helix	trans	-64.9	-40.2	176.5	-177	84.1	0	0	0	113.2	Y97 K103	Y97-W99 PolarHBondContact O-N 3.23Å; Y97-W99 VanDerWaalsContact O-N 3.08Å; W99-K103 HydrophobicContact CD2-CD 4.21Å; W99-K103 HydrophobicContact CE3-CD 4.13Å; W99-K103 HydrophobicContact CH2-CD 3.64Å; W99-K103 VanDerWaalsContact CH2-CE 3.45Å; W99-K103 HydrophobicContact CZ2-CD 3.67Å; W99-K103 HydrophobicContact CZ3-CD 3.84Å; W99-K103 PolarHBondContact O-N 2.86Å
100	H	94.7	Very high	95	Very high	91 Å²	91	29.1 Å²	29.1	42%	0.421	15%	0.145	S	C	.	.	H	α-helix	trans	-68.6	-42.2	176.3	-67	-75	0	0	0	111.5	Y97 V102 K103 I104	Y97-H100 WeakPolarHBondContact O-CA 3.22Å; Y97-H100 WeakPolarHBondContact O-CB 3.36Å; Y97-H100 PolarHBondContact O-N 2.87Å; H100-V102 PolarHBondContact O-N 3.08Å; H100-K103 PolarHBondContact O-N 2.87Å; H100-I104 VanDerWaalsContact O-CG1 3.31Å; H100-I104 WeakPolarHBondContact O-CG1 3.49Å; H100-I104 PolarHBondContact O-N 3.48Å
101	I	96.2	Very high	95.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-55.1	-51.7	174.2	-69.8	157.9	0	0	0	110	Y93 Y97 T98 K103 I104 L105 F224 L250 I251	Y93-I101 HydrophobicContact CD1-CD1 3.78Å; Y93-I101 HydrophobicContact CD1-CG2 3.94Å; Y93-I101 HydrophobicContact CE1-CG2 3.65Å; Y93-I101 HydrophobicContact CG-CD1 4.45Å; Y97-I101 WeakPolarHBondContact O-CG1 3.32Å; Y97-I101 PolarHBondContact O-N 3.46Å; T98-I101 PolarHBondContact O-N 3.28Å; I101-K103 VanDerWaalsContact C-N 3.34Å; I101-K103 PolarHBondContact O-N 3.05Å; I101-I104 PolarHBondContact O-N 3.31Å; I101-L105 HydrophobicContact CG2-CD1 3.96Å; I101-L105 WeakPolarHBondContact O-CG 3.44Å; I101-L105 PolarHBondContact O-N 3.48Å; I101-F224 HydrophobicContact CB-CZ 4.45Å; I101-F224 HydrophobicContact CG1-CE2 4.28Å; I101-F224 HydrophobicContact CG2-CE2 4.15Å; I101-F224 HydrophobicContact CG2-CZ 3.93Å; I101-L250 HydrophobicContact CD1-CB 4.15Å; I101-L250 HydrophobicContact CG1-CB 3.81Å; I101-L250 HydrophobicContact CG1-CD1 4.15Å; I101-I251 HydrophobicContact CD1-CD1 4.17Å; I101-I251 HydrophobicContact CG1-CD1 4.44Å
102	V	96.2	Very high	95.2	Very high	10 Å²	10	31.9 Å²	31.9	6%	0.061	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-44.4	177.9	171	0	0	0	0	111.1	T98 H100 I104 L105 Q106 K168 V175	T98-V102 WeakPolarHBondContact O-CG2 3.36Å; T98-V102 PolarHBondContact O-N 2.9Å; H100-V102 PolarHBondContact O-N 3.08Å; V102-I104 PolarHBondContact O-N 2.76Å; V102-L105 PolarHBondContact O-N 3.22Å; V102-Q106 HydrophobicContact CG1-CG 4.39Å; V102-Q106 WeakPolarHBondContact O-CB 3.19Å; V102-Q106 VanDerWaalsContact O-CG 3.27Å; V102-Q106 WeakPolarHBondContact O-CG 3.36Å; V102-Q106 PolarHBondContact O-N 2.96Å; V102-K168 HydrophobicContact CG2-CB 4.26Å; V102-V175 HydrophobicContact CG2-CG1 4.2Å; V102-V175 HydrophobicContact CG2-CG2 3.81Å
103	K	96.8	Very high	95.4	Very high	30 Å²	30	31.9 Å²	31.9	13%	0.13	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-39.1	177.3	-82.7	-164.4	162.8	-169.4	0	113.3	W99 H100 I101 Q106 T107 N144	W99-K103 HydrophobicContact CD2-CD 4.21Å; W99-K103 HydrophobicContact CE3-CD 4.13Å; W99-K103 HydrophobicContact CH2-CD 3.64Å; W99-K103 VanDerWaalsContact CH2-CE 3.45Å; W99-K103 HydrophobicContact CZ2-CD 3.67Å; W99-K103 HydrophobicContact CZ3-CD 3.84Å; W99-K103 PolarHBondContact O-N 2.86Å; H100-K103 PolarHBondContact O-N 2.87Å; I101-K103 VanDerWaalsContact C-N 3.34Å; I101-K103 PolarHBondContact O-N 3.05Å; K103-Q106 PolarHBondContact O-N 3.43Å; K103-T107 PolarHBondContact O-N 3.18Å; K103-T107 VanDerWaalsContact O-N 3.11Å; K103-T107 PolarHBondContact O-OG1 2.94Å; K103-N144 PolarHBondContact NZ-OD1 3.38Å
104	I	97.5	Very high	95.5	Very high	9 Å²	9	34.6 Å²	34.6	5%	0.046	17%	0.174	C	C	.	.	H	α-helix	trans	-66	-46.6	175.7	-66.5	164.8	0	0	0	109.4	H100 I101 V102 Q106 T107 I108 F224 I227 L235 M237 P247 L250	H100-I104 VanDerWaalsContact O-CG1 3.31Å; H100-I104 WeakPolarHBondContact O-CG1 3.49Å; H100-I104 PolarHBondContact O-N 3.48Å; I101-I104 PolarHBondContact O-N 3.31Å; V102-I104 PolarHBondContact O-N 2.76Å; I104-Q106 VanDerWaalsContact C-N 3.27Å; I104-Q106 PolarHBondContact O-N 3.04Å; I104-T107 WeakPolarHBondContact O-CA 3.41Å; I104-T107 WeakPolarHBondContact O-CB 3.04Å; I104-T107 PolarHBondContact O-N 2.95Å; I104-I108 HydrophobicContact CG2-CD1 4.49Å; I104-I108 HydrophobicContact CG2-CG2 4.38Å; I104-I108 PolarHBondContact O-N 3.1Å; I104-F224 HydrophobicContact CB-CE1 4.1Å; I104-F224 HydrophobicContact CB-CZ 4.18Å; I104-F224 HydrophobicContact CG2-CD1 4.08Å; I104-F224 HydrophobicContact CG2-CE1 3.5Å; I104-F224 HydrophobicContact CG2-CZ 4.03Å; I104-I227 HydrophobicContact CG2-CD1 4.33Å; I104-L235 HydrophobicContact CG2-CD1 4.01Å; I104-M237 HydrophobicContact CD1-SD 4.2Å; I104-P247 HydrophobicContact CD1-CB 4.3Å; I104-L250 HydrophobicContact CD1-CD1 3.47Å; I104-L250 VanDerWaalsContact CD1-CD1 3.47Å
105	L	97.7	Very high	95.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.5	-39.9	174.8	-70.6	170.2	0	0	0	111.6	I101 V102 T107 I108 K110 V166 V175 I215 A220 L223 F224	I101-L105 HydrophobicContact CG2-CD1 3.96Å; I101-L105 WeakPolarHBondContact O-CG 3.44Å; I101-L105 PolarHBondContact O-N 3.48Å; V102-L105 PolarHBondContact O-N 3.22Å; L105-T107 PolarHBondContact O-N 3.3Å; L105-I108 HydrophobicContact CD2-CD1 4.48Å; L105-K110 WeakPolarHBondContact O-CE 3.39Å; L105-K110 PolarHBondContact O-NZ 3.44Å; L105-V166 HydrophobicContact CB-CG1 4.15Å; L105-V175 HydrophobicContact CD1-CB 4.46Å; L105-V175 HydrophobicContact CD1-CG1 3.8Å; L105-I215 HydrophobicContact CD1-CD1 4.36Å; L105-I215 HydrophobicContact CD1-CG2 4.22Å; L105-I215 HydrophobicContact CD2-CD1 4.4Å; L105-I215 HydrophobicContact CD2-CG2 4.45Å; L105-A220 HydrophobicContact CD1-CB 4.45Å; L105-A220 HydrophobicContact CD2-CB 4.48Å; L105-L223 HydrophobicContact CD2-CD1 3.98Å; L105-F224 HydrophobicContact CD2-CE1 3.69Å; L105-F224 HydrophobicContact CD2-CZ 4.19Å; L105-F224 HydrophobicContact CG-CE1 3.89Å; L105-F224 HydrophobicContact CG-CZ 3.99Å
106	Q	97.3	Very high	96.1	Very high	44 Å²	44	32.2 Å²	32.2	21%	0.206	16%	0.162	C	C	.	.	H	α-helix	trans	-65.5	-22.9	172.9	-72	169.6	-16.1	0	0	113.8	V102 K103 I104 H147 V166	V102-Q106 HydrophobicContact CG1-CG 4.39Å; V102-Q106 WeakPolarHBondContact O-CB 3.19Å; V102-Q106 VanDerWaalsContact O-CG 3.27Å; V102-Q106 WeakPolarHBondContact O-CG 3.36Å; V102-Q106 PolarHBondContact O-N 2.96Å; K103-Q106 PolarHBondContact O-N 3.43Å; I104-Q106 VanDerWaalsContact C-N 3.27Å; I104-Q106 PolarHBondContact O-N 3.04Å; Q106-H147 PolarHBondContact OE1-NE2 3.24Å; Q106-V166 HydrophobicContact CG-CB 3.82Å; Q106-V166 HydrophobicContact CG-CG1 4.47Å; Q106-V166 PolarHBondContact NE2-O 3.38Å
107	T	98	Very high	96.4	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-88.8	-30	-177.5	-50.7	0	0	0	0	112.4	K103 I104 L105 V115 L116 R143 I146 L235	K103-T107 PolarHBondContact O-N 3.18Å; K103-T107 VanDerWaalsContact O-N 3.11Å; K103-T107 PolarHBondContact O-OG1 2.94Å; I104-T107 WeakPolarHBondContact O-CA 3.41Å; I104-T107 WeakPolarHBondContact O-CB 3.04Å; I104-T107 PolarHBondContact O-N 2.95Å; L105-T107 PolarHBondContact O-N 3.3Å; T107-V115 HydrophobicContact CG2-CG1 3.98Å; T107-V115 HydrophobicContact CG2-CG2 4.39Å; T107-L116 WeakPolarHBondContact O-CB 3.42Å; T107-L116 PolarHBondContact O-N 2.98Å; T107-R143 PolarHBondContact OG1-NH2 3.16Å; T107-R143 VanDerWaalsContact OG1-NH2 3.1Å; T107-I146 HydrophobicContact CG2-CG2 4.14Å; T107-L235 HydrophobicContact CG2-CD2 3.84Å
108	I	98	Very high	96.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-102.1	158.6	-174.6	69.9	178.4	0	0	0	112.9	I104 L105 K110 R114 V115 L223 F224 I227	I104-I108 HydrophobicContact CG2-CD1 4.49Å; I104-I108 HydrophobicContact CG2-CG2 4.38Å; I104-I108 PolarHBondContact O-N 3.1Å; L105-I108 HydrophobicContact CD2-CD1 4.48Å; I108-K110 WeakPolarHBondContact O-CD 3.27Å; I108-K110 PolarHBondContact O-NZ 2.86Å; I108-R114 CarbonylContact C-O 3.51Å; I108-R114 WeakPolarHBondContact CA-O 3.35Å; I108-V115 HydrophobicContact CG2-CG2 4.26Å; I108-L223 HydrophobicContact CD1-CB 4.34Å; I108-F224 HydrophobicContact CD1-CD1 4.01Å; I108-F224 HydrophobicContact CD1-CE1 4.13Å; I108-I227 HydrophobicContact CD1-CD1 4Å; I108-I227 HydrophobicContact CD1-CG1 4.19Å; I108-I227 HydrophobicContact CG2-CD1 4.2Å; I108-I227 HydrophobicContact CG2-CG1 4.42Å
109	C	97.8	Very high	96.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.158	C	C	.	.			trans	-70.9	135.3	168.9	-175.6	0	0	0	0	111.1	T111 S113 R114 L116 C156 C159 N163	C109-T111 PolarHBondContact O-N 2.67Å; C109-T111 PolarHBondContact SG-N 3.04Å; C109-S113 WeakPolarHBondContact O-CA 3.41Å; C109-S113 PolarHBondContact O-N 2.64Å; C109-R114 PolarHBondContact N-O 3.02Å; C109-L116 HydrophobicContact CB-CD2 3.91Å; C109-L116 HydrophobicContact CB-CG 4.47Å; C109-C156 HydrophobicContact CB-CB 4.35Å; C109-C156 VanDerWaalsContact SG-SG 3.65Å; C109-C159 VanDerWaalsContact SG-SG 3.63Å; C109-N163 WeakPolarHBondContact CA-OD1 3.44Å; C109-N163 PolarHBondContact SG-ND2 3.34Å; C109-N163 VanDerWaalsContact SG-ND2 3.43Å
110	K	97	Very high	96.8	Very high	14 Å²	14	31.9 Å²	31.9	6%	0.061	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.2	-179.7	-74.8	59.9	155.7	-172.5	0	113.1	L105 I108 N163 I215 L223	L105-K110 WeakPolarHBondContact O-CE 3.39Å; L105-K110 PolarHBondContact O-NZ 3.44Å; I108-K110 WeakPolarHBondContact O-CD 3.27Å; I108-K110 PolarHBondContact O-NZ 2.86Å; K110-N163 WeakPolarHBondContact CD-OD1 3.36Å; K110-N163 PolarHBondContact N-OD1 2.84Å; K110-I215 HydrophobicContact CG-CD1 4.12Å; K110-L223 HydrophobicContact CG-CD1 4.28Å; K110-L223 VanDerWaalsContact O-CD2 3.32Å; K110-L223 WeakPolarHBondContact O-CD2 3.46Å
111	T	96.1	Very high	96.8	Very high	82 Å²	82	30.9 Å²	30.9	50%	0.503	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-56	178.2	-46.9	0	0	0	0	110.8	C109 A161 R226	C109-T111 PolarHBondContact O-N 2.67Å; C109-T111 PolarHBondContact SG-N 3.04Å; T111-A161 HydrophobicContact CG2-CB 4.32Å; T111-A161 VanDerWaalsContact OG1-CB 3.25Å; T111-A161 WeakPolarHBondContact OG1-CB 3.36Å; T111-R226 PolarHBondContact O-NH1 3.06Å
112	C	97	Very high	96.8	Very high	41 Å²	41	31.4 Å²	31.4	28%	0.277	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	1.2	-176.3	74.3	0	0	0	0	114.7	R114 C156 C159	C112-R114 PolarHBondContact O-N 3.11Å; C112-C156 VanDerWaalsContact SG-SG 3.65Å; C112-C159 HydrophobicContact CB-CB 4.08Å
113	S	97.8	Very high	96.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.			trans	60.3	-2.5	178.2	-64.2	0	0	0	0	117.8	C109 L223 R226	C109-S113 WeakPolarHBondContact O-CA 3.41Å; C109-S113 PolarHBondContact O-N 2.64Å; S113-L223 VanDerWaalsContact CB-O 3.29Å; S113-L223 WeakPolarHBondContact CB-O 3.26Å; S113-L223 WeakPolarHBondContact OG-CA 3.5Å; S113-L223 PolarHBondContact OG-O 2.89Å; S113-R226 WeakPolarHBondContact CB-O 3.45Å; S113-R226 WeakPolarHBondContact OG-CB 3.49Å
114	R	97.3	Very high	96.6	Very high	61 Å²	61	39.6 Å²	39.6	23%	0.23	20%	0.197	C	C	.	.			trans	-60	147.5	171.7	-69.7	-91.9	179	-167.8	-1.5	111.2	I108 C109 C112 L116 F158 P228 E230 D231	I108-R114 CarbonylContact C-O 3.51Å; I108-R114 WeakPolarHBondContact CA-O 3.35Å; C109-R114 PolarHBondContact N-O 3.02Å; C112-R114 PolarHBondContact O-N 3.11Å; R114-L116 PolarHBondContact O-N 3.26Å; R114-F158 HydrophobicContact CB-CD2 3.58Å; R114-F158 HydrophobicContact CB-CE2 3.96Å; R114-F158 HydrophobicContact CB-CG 4.18Å; R114-F158 HydrophobicContact CG-CB 4.38Å; R114-F158 HydrophobicContact CG-CD2 4Å; R114-F158 HydrophobicContact CG-CG 4.08Å; R114-P228 HydrophobicContact CG-CG 4.35Å; R114-E230 IonicContact CZ-OE1 3.88Å; R114-E230 VanDerWaalsContact NH1-CD 3.26Å; R114-E230 IonicContact NH1-OE1 3.88Å; R114-E230 PolarHBondContact NH1-OE1 3.27Å; R114-E230 IonicContact NH1-OE2 3.41Å; R114-E230 IonicContact NH2-OE1 2.69Å; R114-E230 PolarHBondContact NH2-OE1 3.46Å; R114-D231 WeakPolarHBondContact CA-OD2 3.46Å; R114-D231 WeakPolarHBondContact CD-OD2 3.44Å; R114-D231 IonicContact NH1-OD1 3.37Å
115	V	97.5	Very high	96.6	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-63.7	129.6	170.6	166.9	0	0	0	0	109.4	T107 I108 L117 F158 D231 L234 L235	T107-V115 HydrophobicContact CG2-CG1 3.98Å; T107-V115 HydrophobicContact CG2-CG2 4.39Å; I108-V115 HydrophobicContact CG2-CG2 4.26Å; V115-L117 HydrophobicContact CG1-CB 4.3Å; V115-L117 HydrophobicContact CG1-CD1 3.95Å; V115-L117 HydrophobicContact CG1-CG 3.87Å; V115-L117 PolarHBondContact O-N 3.47Å; V115-F158 WeakPolarHBondContact O-CE2 3.42Å; V115-D231 HydrophobicContact CG2-CB 3.97Å; V115-D231 PolarHBondContact N-OD2 3.41Å; V115-L234 HydrophobicContact CB-CD1 4.15Å; V115-L234 HydrophobicContact CG1-CB 4.45Å; V115-L234 HydrophobicContact CG1-CD1 4.13Å; V115-L234 HydrophobicContact CG2-CB 4.27Å; V115-L234 HydrophobicContact CG2-CD1 4.37Å; V115-L235 HydrophobicContact CG2-CD2 4.03Å; V115-L235 HydrophobicContact CG2-CG 4.35Å
116	L	97.7	Very high	96.4	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	21%	0.212	C	C	.	.	S	Bend	trans	-73.7	78.2	179.2	-65.2	168	0	0	0	109.3	T107 C109 R114 S150 I153 C156 N163	T107-L116 WeakPolarHBondContact O-CB 3.42Å; T107-L116 PolarHBondContact O-N 2.98Å; C109-L116 HydrophobicContact CB-CD2 3.91Å; C109-L116 HydrophobicContact CB-CG 4.47Å; R114-L116 PolarHBondContact O-N 3.26Å; L116-S150 WeakPolarHBondContact O-CA 3.48Å; L116-S150 WeakPolarHBondContact O-CB 3.47Å; L116-S150 PolarHBondContact O-OG 2.91Å; L116-I153 HydrophobicContact CB-CB 4.23Å; L116-I153 HydrophobicContact CB-CG2 4.41Å; L116-I153 WeakPolarHBondContact O-CD1 3.27Å; L116-C156 HydrophobicContact CD2-CB 3.97Å; L116-N163 HydrophobicContact CD1-CB 3.97Å
117	L	97.1	Very high	96.1	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.			trans	-139.6	140.1	170.2	-74.4	178.1	0	0	0	108.9	V115 R122 F125 I146 L149	V115-L117 HydrophobicContact CG1-CB 4.3Å; V115-L117 HydrophobicContact CG1-CD1 3.95Å; V115-L117 HydrophobicContact CG1-CG 3.87Å; V115-L117 PolarHBondContact O-N 3.47Å; L117-R122 HydrophobicContact CB-CB 4.23Å; L117-F125 HydrophobicContact CD1-CD2 4.09Å; L117-I146 HydrophobicContact CD1-CG2 4.13Å; L117-L149 HydrophobicContact CD2-CB 3.79Å; L117-L149 HydrophobicContact CD2-CD1 4.49Å
118	P	95.9	Very high	95.9	Very high	50 Å²	50	49.5 Å²	49.5	33%	0.325	25%	0.253	S	S	.	.			trans	-63.7	148.8	170.4	-17.7	32.2	0	0	0	110.4	Q120 Q121 R122 I153	P118-Q120 VanDerWaalsContact C-N 3.25Å; P118-Q120 PolarHBondContact O-N 3.4Å; P118-Q120 VanDerWaalsContact O-N 3.09Å; P118-Q121 PolarHBondContact O-N 2.84Å; P118-R122 PolarHBondContact O-N 3.27Å; P118-I153 HydrophobicContact CG-CD1 4.19Å
119	E	94.7	Very high	95.5	Very high	97 Å²	97	50.2 Å²	50.2	45%	0.453	26%	0.257	S	S	.	.	H	α-helix	trans	-53	-40.4	-170.7	-161.7	58.4	-141.4	0	0	113.5	Q121 R122 A123 F158	E119-Q121 PolarHBondContact O-N 2.86Å; E119-R122 WeakPolarHBondContact O-CB 3.19Å; E119-R122 PolarHBondContact O-N 3.05Å; E119-R122 IonicContact OE1-CZ 3.17Å; E119-R122 IonicContact OE1-NH1 3.09Å; E119-R122 PolarHBondContact OE1-NH1 2.72Å; E119-A123 WeakPolarHBondContact O-CB 3.47Å; E119-A123 PolarHBondContact O-N 3.41Å; E119-F158 WeakPolarHBondContact OE2-CE1 3.28Å
120	Q	94	Very high	95.1	Very high	139 Å²	139	53.7 Å²	53.7	65%	0.65	28%	0.282	S	S	*	.	H	α-helix	trans	-64.6	-39.2	178.9	-165.2	-177.3	32.5	0	0	112.9	P118 R124	P118-Q120 VanDerWaalsContact C-N 3.25Å; P118-Q120 PolarHBondContact O-N 3.4Å; P118-Q120 VanDerWaalsContact O-N 3.09Å; Q120-R124 WeakPolarHBondContact O-CG 3.43Å; Q120-R124 PolarHBondContact O-N 3.28Å
121	Q	95.3	Very high	94.6	Very high	69 Å²	69	56.4 Å²	56.4	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-73.7	-41.1	176.3	-65.1	-177.2	11.5	0	0	110.5	P118 E119 A123 R124 F125	P118-Q121 PolarHBondContact O-N 2.84Å; E119-Q121 PolarHBondContact O-N 2.86Å; Q121-A123 PolarHBondContact O-N 2.74Å; Q121-R124 PolarHBondContact O-N 3.07Å; Q121-F125 HydrophobicContact CB-CD2 4.49Å; Q121-F125 VanDerWaalsContact O-CD2 3.25Å; Q121-F125 WeakPolarHBondContact O-CD2 3.47Å; Q121-F125 PolarHBondContact O-N 3.24Å
122	R	95.5	Very high	94	Very high	12 Å²	12	57.4 Å²	57.4	5%	0.045	31%	0.305	C	S	.	.	H	α-helix	trans	-53.1	-53.1	175.6	-173.6	-177.8	167.9	-94.9	-5.8	110.8	L117 P118 E119 R124 F125 L126 E230 D231 L234	L117-R122 HydrophobicContact CB-CB 4.23Å; P118-R122 PolarHBondContact O-N 3.27Å; E119-R122 WeakPolarHBondContact O-CB 3.19Å; E119-R122 PolarHBondContact O-N 3.05Å; E119-R122 IonicContact OE1-CZ 3.17Å; E119-R122 IonicContact OE1-NH1 3.09Å; E119-R122 PolarHBondContact OE1-NH1 2.72Å; R122-R124 PolarHBondContact O-N 3.41Å; R122-F125 PolarHBondContact O-N 3.44Å; R122-L126 HydrophobicContact CG-CD1 4.13Å; R122-L126 WeakPolarHBondContact O-CB 3.38Å; R122-L126 VanDerWaalsContact O-CG 3.3Å; R122-L126 WeakPolarHBondContact O-CG 3.49Å; R122-L126 PolarHBondContact O-N 3.11Å; R122-E230 IonicContact CZ-OE2 2.75Å; R122-E230 IonicContact NH1-OE2 2.73Å; R122-E230 VanDerWaalsContact NH2-CG 3.34Å; R122-E230 IonicContact NH2-OE1 2.78Å; R122-E230 IonicContact NH2-OE2 3.96Å; R122-E230 PolarHBondContact NH2-OE2 3.2Å; R122-D231 IonicContact CZ-OD1 3.89Å; R122-D231 IonicContact NE-OD1 3.72Å; R122-D231 PolarHBondContact NE-OD1 3.3Å; R122-D231 IonicContact NH2-OD1 3.72Å; R122-D231 PolarHBondContact NH2-OD1 3.02Å; R122-L234 HydrophobicContact CG-CD1 3.69Å
123	A	94.9	Very high	93.6	Very high	48 Å²	48	62.3 Å²	62.3	40%	0.397	33%	0.328	S	S	.	.	H	α-helix	trans	-57.8	-42.9	178.9	0	0	0	0	0	113.1	E119 Q121 L126 I127	E119-A123 WeakPolarHBondContact O-CB 3.47Å; E119-A123 PolarHBondContact O-N 3.41Å; Q121-A123 PolarHBondContact O-N 2.74Å; A123-L126 PolarHBondContact O-N 2.81Å; A123-I127 PolarHBondContact O-N 2.92Å
124	R	95.4	Very high	93.1	Very high	164 Å²	164	63.6 Å²	63.6	62%	0.619	34%	0.335	S	S	*	.	H	α-helix	trans	-64.4	-46.1	177.9	-72	177.2	-179.4	179.9	1.7	112.5	Q120 Q121 R122 L126 S128	Q120-R124 WeakPolarHBondContact O-CG 3.43Å; Q120-R124 PolarHBondContact O-N 3.28Å; Q121-R124 PolarHBondContact O-N 3.07Å; R122-R124 PolarHBondContact O-N 3.41Å; R124-L126 VanDerWaalsContact C-N 3.35Å; R124-S128 PolarHBondContact O-OG 2.91Å
125	F	95.9	Very high	92.8	Very high	39 Å²	39	64.4 Å²	64.4	17%	0.171	34%	0.344	C	S	.	.	H	α-helix	trans	-69.6	-33.3	179.9	-79.4	-65.5	0	0	0	112.3	L117 Q121 R122 I127 S128 C129 L142 A145 I146 L149 L234	L117-F125 HydrophobicContact CD1-CD2 4.09Å; Q121-F125 HydrophobicContact CB-CD2 4.49Å; Q121-F125 VanDerWaalsContact O-CD2 3.25Å; Q121-F125 WeakPolarHBondContact O-CD2 3.47Å; Q121-F125 PolarHBondContact O-N 3.24Å; R122-F125 PolarHBondContact O-N 3.44Å; F125-I127 VanDerWaalsContact C-N 3.35Å; F125-I127 PolarHBondContact O-N 3.34Å; F125-S128 PolarHBondContact O-N 3.13Å; F125-C129 WeakPolarHBondContact O-CB 3.42Å; F125-C129 PolarHBondContact O-N 3.17Å; F125-C129 PolarHBondContact O-SG 3.05Å; F125-L142 HydrophobicContact CD1-CD2 4.26Å; F125-L142 HydrophobicContact CE1-CD2 4.31Å; F125-A145 HydrophobicContact CE1-CB 4.38Å; F125-A145 HydrophobicContact CZ-CB 4.5Å; F125-I146 HydrophobicContact CB-CD1 4.1Å; F125-I146 HydrophobicContact CB-CG1 4.29Å; F125-I146 HydrophobicContact CD1-CD1 4.04Å; F125-I146 HydrophobicContact CD1-CG1 3.74Å; F125-I146 HydrophobicContact CD2-CG1 4.21Å; F125-I146 HydrophobicContact CE1-CG1 4.08Å; F125-I146 HydrophobicContact CG-CD1 4.12Å; F125-I146 HydrophobicContact CG-CG1 3.82Å; F125-I146 HydrophobicContact CZ-CG1 4.46Å; F125-L149 HydrophobicContact CE2-CD1 3.51Å; F125-L149 HydrophobicContact CZ-CD1 3.74Å; F125-L234 HydrophobicContact CB-CD2 3.55Å
126	L	93.5	Very high	92.5	Very high	33 Å²	33	72.5 Å²	72.5	17%	0.173	38%	0.376	C	S	.	.	H	α-helix	trans	-56.7	-47.8	175.6	-79.2	170.9	0	0	0	111.6	R122 A123 R124 S128 C129 S130 E230 P233 L234	R122-L126 HydrophobicContact CG-CD1 4.13Å; R122-L126 WeakPolarHBondContact O-CB 3.38Å; R122-L126 VanDerWaalsContact O-CG 3.3Å; R122-L126 WeakPolarHBondContact O-CG 3.49Å; R122-L126 PolarHBondContact O-N 3.11Å; A123-L126 PolarHBondContact O-N 2.81Å; R124-L126 VanDerWaalsContact C-N 3.35Å; L126-S128 VanDerWaalsContact C-N 3.27Å; L126-S128 PolarHBondContact O-N 3.23Å; L126-C129 PolarHBondContact O-N 3.43Å; L126-S130 VanDerWaalsContact O-CB 3.32Å; L126-S130 WeakPolarHBondContact O-CB 3.49Å; L126-S130 PolarHBondContact O-N 3.14Å; L126-S130 PolarHBondContact O-OG 2.99Å; L126-E230 VanDerWaalsContact CD2-O 3.23Å; L126-E230 WeakPolarHBondContact CD2-O 3.38Å; L126-P233 HydrophobicContact CD2-CB 4.26Å; L126-L234 HydrophobicContact CD2-CD1 4.06Å; L126-L234 HydrophobicContact CD2-CD2 3.93Å; L126-L234 HydrophobicContact CD2-CG 3.66Å; L126-L234 HydrophobicContact CG-CD1 4.27Å; L126-L234 HydrophobicContact CG-CD2 3.92Å; L126-L234 HydrophobicContact CG-CG 4.1Å
127	I	91.8	Very high	92.4	Very high	136 Å²	136	76.3 Å²	76.3	70%	0.697	40%	0.399	S	S	*	.	H	α-helix	trans	-56.8	-44.6	177.8	-62.7	166.5	0	0	0	110.8	A123 F125	A123-I127 PolarHBondContact O-N 2.92Å; F125-I127 VanDerWaalsContact C-N 3.35Å; F125-I127 PolarHBondContact O-N 3.34Å
128	S	92.8	Very high	92.3	Very high	53 Å²	53	80.7 Å²	80.7	37%	0.371	42%	0.419	S	S	.	.	H	α-helix	trans	-69.3	-41	-178.5	-57.1	0	0	0	0	112.5	R124 F125 L126	R124-S128 PolarHBondContact O-OG 2.91Å; F125-S128 PolarHBondContact O-N 3.13Å; L126-S128 VanDerWaalsContact C-N 3.27Å; L126-S128 PolarHBondContact O-N 3.23Å
129	C	91.6	Very high	92.2	Very high	14 Å²	14	82.3 Å²	82.3	10%	0.095	42%	0.421	C	S	.	.	H	α-helix	trans	-76	-25.5	-176.6	-65.1	0	0	0	0	113.1	F125 L126 N131 P233 L236	F125-C129 WeakPolarHBondContact O-CB 3.42Å; F125-C129 PolarHBondContact O-N 3.17Å; F125-C129 PolarHBondContact O-SG 3.05Å; L126-C129 PolarHBondContact O-N 3.43Å; C129-N131 VanDerWaalsContact C-N 3.28Å; C129-N131 PolarHBondContact O-N 3.18Å; C129-P233 HydrophobicContact CB-CB 4.22Å; C129-P233 WeakPolarHBondContact CB-O 3.31Å; C129-L236 HydrophobicContact CB-CD2 3.79Å
130	S	87.5	Confident	92.2	Very high	74 Å²	74	83.2 Å²	83.2	52%	0.517	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-1.9	178.7	-62.4	0	0	0	0	113.7	L126 P132	L126-S130 VanDerWaalsContact O-CB 3.32Å; L126-S130 WeakPolarHBondContact O-CB 3.49Å; L126-S130 PolarHBondContact O-N 3.14Å; L126-S130 PolarHBondContact O-OG 2.99Å; S130-P132 VanDerWaalsContact O-CD 3.28Å; S130-P132 WeakPolarHBondContact O-CD 3.47Å
131	N	88.1	Confident	92.3	Very high	71 Å²	71	81.9 Å²	81.9	38%	0.38	42%	0.417	S	S	.	.			trans	-70.3	115.2	176.5	-178.2	-3.2	0	0	0	111.1	C129 N133 L134	C129-N131 VanDerWaalsContact C-N 3.28Å; C129-N131 PolarHBondContact O-N 3.18Å; N131-N133 VanDerWaalsContact C-N 3.27Å; N131-N133 PolarHBondContact O-N 3.42Å; N131-N133 PolarHBondContact OD1-N 2.88Å; N131-L134 HydrophobicContact CB-CB 4.49Å; N131-L134 WeakPolarHBondContact O-CB 3.47Å; N131-L134 PolarHBondContact O-N 2.71Å
132	P	83.5	Confident	92.3	Very high	103 Å²	103	80 Å²	80	67%	0.669	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.8	-177.8	27.8	-34.9	0	0	0	113.3	S130 L134	S130-P132 VanDerWaalsContact O-CD 3.28Å; S130-P132 WeakPolarHBondContact O-CD 3.47Å; P132-L134 PolarHBondContact O-N 3.45Å
133	N	87.1	Confident	92.4	Very high	144 Å²	144	81.1 Å²	81.1	77%	0.77	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	9.5	-176.1	-63	-27.9	0	0	0	113	N131 D135	N131-N133 VanDerWaalsContact C-N 3.27Å; N131-N133 PolarHBondContact O-N 3.42Å; N131-N133 PolarHBondContact OD1-N 2.88Å; N133-D135 PolarHBondContact O-N 3.46Å
134	L	88.9	Confident	92.5	Very high	27 Å²	27	82.1 Å²	82.1	14%	0.141	41%	0.412	C	S	.	.			trans	-71.5	123.6	-178.3	-163.1	73.9	0	0	0	110.8	N131 P132 H138 K139 L142	N131-L134 HydrophobicContact CB-CB 4.49Å; N131-L134 WeakPolarHBondContact O-CB 3.47Å; N131-L134 PolarHBondContact O-N 2.71Å; P132-L134 PolarHBondContact O-N 3.45Å; L134-H138 HydrophobicContact CD1-CB 3.64Å; L134-H138 HydrophobicContact CD2-CB 4.46Å; L134-H138 HydrophobicContact CG-CB 3.92Å; L134-K139 HydrophobicContact CB-CG 4.28Å; L134-K139 HydrophobicContact CD2-CB 4.41Å; L134-K139 HydrophobicContact CD2-CG 3.57Å; L134-K139 HydrophobicContact CG-CG 3.97Å; L134-K139 WeakPolarHBondContact O-CE 3.48Å; L134-K139 PolarHBondContact O-NZ 3.47Å; L134-L142 HydrophobicContact CD2-CD1 3.44Å; L134-L142 VanDerWaalsContact CD2-CD1 3.44Å; L134-L142 HydrophobicContact CD2-CG 4.5Å
135	D	90.9	Very high	92.6	Very high	78 Å²	78	76.2 Å²	76.2	42%	0.417	40%	0.399	S	S	.	.			trans	-69	171.6	177.6	75	21.6	0	0	0	112.3	N133 V137 H138 K139	N133-D135 PolarHBondContact O-N 3.46Å; D135-V137 PolarHBondContact O-N 3.48Å; D135-V137 PolarHBondContact OD1-N 3.45Å; D135-H138 WeakPolarHBondContact OD1-CB 3.05Å; D135-H138 IonicContact OD1-CE1 2.82Å; D135-H138 IonicContact OD1-CG 2.86Å; D135-H138 PolarHBondContact OD1-N 3.21Å; D135-H138 IonicContact OD1-ND1 3.94Å; D135-H138 PolarHBondContact OD1-ND1 2.55Å; D135-H138 IonicContact OD2-CE1 3.21Å; D135-H138 PolarHBondContact OD2-CE1 3.03Å; D135-H138 IonicContact OD2-ND1 3.4Å; D135-H138 PolarHBondContact OD2-ND1 3.21Å; D135-K139 WeakPolarHBondContact O-CB 3.45Å; D135-K139 WeakPolarHBondContact O-CD 3.49Å; D135-K139 WeakPolarHBondContact O-CG 3.48Å; D135-K139 PolarHBondContact O-N 2.86Å; D135-K139 VanDerWaalsContact O-N 3.08Å
136	Y	91.1	Very high	92.6	Very high	170 Å²	170	74.4 Å²	74.4	67%	0.667	39%	0.39	S	S	*	.	H	α-helix	trans	-64.7	-37	-178.7	174.7	-102.6	0	0	0	113.6	K139 K140	Y136-K139 WeakPolarHBondContact O-CB 3.29Å; Y136-K139 PolarHBondContact O-N 3.4Å; Y136-K140 HydrophobicContact CE1-CD 4.46Å; Y136-K140 WeakPolarHBondContact O-CB 3.41Å; Y136-K140 PolarHBondContact O-N 3.45Å
137	V	95.7	Very high	92.8	Very high	82 Å²	82	74.1 Å²	74.1	50%	0.497	39%	0.388	S	S	.	.	H	α-helix	trans	-70	-46.9	-174.7	177.4	0	0	0	0	110.1	D135 K140 Q141	D135-V137 PolarHBondContact O-N 3.48Å; D135-V137 PolarHBondContact OD1-N 3.45Å; V137-K140 WeakPolarHBondContact O-CB 3.32Å; V137-K140 PolarHBondContact O-N 3.3Å; V137-Q141 WeakPolarHBondContact O-CG 3.36Å; V137-Q141 PolarHBondContact O-N 2.89Å
138	H	95.1	Very high	93.1	Very high	91 Å²	91	73.4 Å²	73.4	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-65.5	-38.9	176.2	-66.5	97.1	0	0	0	111.4	L134 D135 K140 Q141 L142	L134-H138 HydrophobicContact CD1-CB 3.64Å; L134-H138 HydrophobicContact CD2-CB 4.46Å; L134-H138 HydrophobicContact CG-CB 3.92Å; D135-H138 WeakPolarHBondContact OD1-CB 3.05Å; D135-H138 IonicContact OD1-CE1 2.82Å; D135-H138 IonicContact OD1-CG 2.86Å; D135-H138 PolarHBondContact OD1-N 3.21Å; D135-H138 IonicContact OD1-ND1 3.94Å; D135-H138 PolarHBondContact OD1-ND1 2.55Å; D135-H138 IonicContact OD2-CE1 3.21Å; D135-H138 PolarHBondContact OD2-CE1 3.03Å; D135-H138 IonicContact OD2-ND1 3.4Å; D135-H138 PolarHBondContact OD2-ND1 3.21Å; H138-K140 PolarHBondContact O-N 3.31Å; H138-Q141 PolarHBondContact O-N 2.72Å; H138-L142 WeakPolarHBondContact O-CG 3.31Å; H138-L142 PolarHBondContact O-N 2.84Å
139	K	93	Very high	93.3	Very high	84 Å²	84	73.6 Å²	73.6	37%	0.365	38%	0.377	S	S	.	.	H	α-helix	trans	-54	-51.6	168.9	-79.2	171.1	177.4	158.1	0	110.8	L134 D135 Y136 Q141 L142 R143 L236	L134-K139 HydrophobicContact CB-CG 4.28Å; L134-K139 HydrophobicContact CD2-CB 4.41Å; L134-K139 HydrophobicContact CD2-CG 3.57Å; L134-K139 HydrophobicContact CG-CG 3.97Å; L134-K139 WeakPolarHBondContact O-CE 3.48Å; L134-K139 PolarHBondContact O-NZ 3.47Å; D135-K139 WeakPolarHBondContact O-CB 3.45Å; D135-K139 WeakPolarHBondContact O-CD 3.49Å; D135-K139 WeakPolarHBondContact O-CG 3.48Å; D135-K139 PolarHBondContact O-N 2.86Å; D135-K139 VanDerWaalsContact O-N 3.08Å; Y136-K139 WeakPolarHBondContact O-CB 3.29Å; Y136-K139 PolarHBondContact O-N 3.4Å; K139-Q141 VanDerWaalsContact C-N 3.3Å; K139-Q141 PolarHBondContact O-N 2.9Å; K139-L142 PolarHBondContact O-N 2.86Å; K139-R143 PolarHBondContact O-N 2.93Å; K139-L236 VanDerWaalsContact C-CD1 3.49Å; K139-L236 HydrophobicContact CB-CD1 3.8Å; K139-L236 HydrophobicContact CG-CD1 4.24Å; K139-L236 WeakPolarHBondContact O-CD1 3.49Å
140	K	94.6	Very high	93.6	Very high	117 Å²	117	73 Å²	73	51%	0.509	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-39.9	179.2	-173.2	177.2	179.4	179.5	0	112.5	Y136 V137 H138 N144	Y136-K140 HydrophobicContact CE1-CD 4.46Å; Y136-K140 WeakPolarHBondContact O-CB 3.41Å; Y136-K140 PolarHBondContact O-N 3.45Å; V137-K140 WeakPolarHBondContact O-CB 3.32Å; V137-K140 PolarHBondContact O-N 3.3Å; H138-K140 PolarHBondContact O-N 3.31Å; K140-N144 PolarHBondContact O-N 3.04Å; K140-N144 VanDerWaalsContact O-N 3.16Å; K140-N144 PolarHBondContact O-ND2 2.65Å
141	Q	96.4	Very high	93.9	Very high	111 Å²	111	71.9 Å²	71.9	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-64.8	-48.8	176.5	-70.9	173.6	-1	0	0	111.9	V137 H138 K139 R143 N144 A145	V137-Q141 WeakPolarHBondContact O-CG 3.36Å; V137-Q141 PolarHBondContact O-N 2.89Å; H138-Q141 PolarHBondContact O-N 2.72Å; K139-Q141 VanDerWaalsContact C-N 3.3Å; K139-Q141 PolarHBondContact O-N 2.9Å; Q141-R143 VanDerWaalsContact C-N 3.35Å; Q141-R143 PolarHBondContact O-N 3.18Å; Q141-N144 PolarHBondContact O-N 3.08Å; Q141-A145 PolarHBondContact O-N 2.77Å
142	L	96	Very high	94.2	Very high	30 Å²	30	76.2 Å²	76.2	16%	0.157	38%	0.376	C	S	.	.	H	α-helix	trans	-57.8	-46.4	176.5	-74.9	-178.4	0	0	0	111.5	F125 L134 H138 K139 N144 A145 I146 L236	F125-L142 HydrophobicContact CD1-CD2 4.26Å; F125-L142 HydrophobicContact CE1-CD2 4.31Å; L134-L142 HydrophobicContact CD2-CD1 3.44Å; L134-L142 VanDerWaalsContact CD2-CD1 3.44Å; L134-L142 HydrophobicContact CD2-CG 4.5Å; H138-L142 WeakPolarHBondContact O-CG 3.31Å; H138-L142 PolarHBondContact O-N 2.84Å; K139-L142 PolarHBondContact O-N 2.86Å; L142-N144 VanDerWaalsContact C-N 3.28Å; L142-N144 PolarHBondContact O-N 2.86Å; L142-A145 PolarHBondContact O-N 2.98Å; L142-A145 VanDerWaalsContact O-N 3.17Å; L142-I146 WeakPolarHBondContact O-CG1 3.44Å; L142-I146 PolarHBondContact O-N 2.86Å; L142-L236 HydrophobicContact CB-CD1 4.42Å
143	R	96.1	Very high	94.8	Very high	34 Å²	34	73.1 Å²	73.1	13%	0.128	35%	0.353	C	S	.	.	H	α-helix	trans	-58.4	-42.3	178.5	-175.4	64.3	-168.7	133.6	7.1	112	T107 K139 Q141 H147 L236	T107-R143 PolarHBondContact OG1-NH2 3.16Å; T107-R143 VanDerWaalsContact OG1-NH2 3.1Å; K139-R143 PolarHBondContact O-N 2.93Å; Q141-R143 VanDerWaalsContact C-N 3.35Å; Q141-R143 PolarHBondContact O-N 3.18Å; R143-H147 WeakPolarHBondContact O-CB 3.38Å; R143-H147 PolarHBondContact O-N 3.22Å; R143-L236 HydrophobicContact CB-CD1 3.77Å; R143-L236 HydrophobicContact CB-CG 4.47Å
144	N	97.1	Very high	95.1	Very high	70 Å²	70	68.8 Å²	68.8	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-69.3	-38.4	178.4	-74.2	-27.1	0	0	0	112.2	K103 K140 Q141 L142 K148	K103-N144 PolarHBondContact NZ-OD1 3.38Å; K140-N144 PolarHBondContact O-N 3.04Å; K140-N144 VanDerWaalsContact O-N 3.16Å; K140-N144 PolarHBondContact O-ND2 2.65Å; Q141-N144 PolarHBondContact O-N 3.08Å; L142-N144 VanDerWaalsContact C-N 3.28Å; L142-N144 PolarHBondContact O-N 2.86Å; N144-K148 VanDerWaalsContact O-CB 3.29Å; N144-K148 WeakPolarHBondContact O-CB 3.39Å; N144-K148 PolarHBondContact O-N 3.4Å
145	A	97.4	Very high	95.4	Very high	40 Å²	40	70.9 Å²	70.9	33%	0.331	34%	0.342	S	S	.	.	H	α-helix	trans	-64.1	-49.4	176.8	0	0	0	0	0	111.7	F125 Q141 L142 K148 L149	F125-A145 HydrophobicContact CE1-CB 4.38Å; F125-A145 HydrophobicContact CZ-CB 4.5Å; Q141-A145 PolarHBondContact O-N 2.77Å; L142-A145 PolarHBondContact O-N 2.98Å; L142-A145 VanDerWaalsContact O-N 3.17Å; A145-K148 PolarHBondContact O-N 3.49Å; A145-L149 WeakPolarHBondContact O-CG 3.41Å; A145-L149 PolarHBondContact O-N 3.02Å; A145-L149 VanDerWaalsContact O-N 3.09Å
146	I	97.4	Very high	95.6	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-50.4	176.5	-69.1	168.5	0	0	0	110.2	T107 L117 F125 L142 K148 L149 S150 L234	T107-I146 HydrophobicContact CG2-CG2 4.14Å; L117-I146 HydrophobicContact CD1-CG2 4.13Å; F125-I146 HydrophobicContact CB-CD1 4.1Å; F125-I146 HydrophobicContact CB-CG1 4.29Å; F125-I146 HydrophobicContact CD1-CD1 4.04Å; F125-I146 HydrophobicContact CD1-CG1 3.74Å; F125-I146 HydrophobicContact CD2-CG1 4.21Å; F125-I146 HydrophobicContact CE1-CG1 4.08Å; F125-I146 HydrophobicContact CG-CD1 4.12Å; F125-I146 HydrophobicContact CG-CG1 3.82Å; F125-I146 HydrophobicContact CZ-CG1 4.46Å; L142-I146 WeakPolarHBondContact O-CG1 3.44Å; L142-I146 PolarHBondContact O-N 2.86Å; I146-K148 VanDerWaalsContact C-N 3.34Å; I146-K148 PolarHBondContact O-N 3.01Å; I146-L149 PolarHBondContact O-N 3.26Å; I146-S150 WeakPolarHBondContact O-CB 3.27Å; I146-S150 PolarHBondContact O-N 3.21Å; I146-S150 PolarHBondContact O-OG 3.47Å; I146-L234 HydrophobicContact CD1-CB 4.46Å; I146-L234 HydrophobicContact CD1-CD2 4.25Å; I146-L234 WeakPolarHBondContact CD1-O 3.4Å
147	H	97.6	Very high	95.9	Very high	27 Å²	27	62.2 Å²	62.2	13%	0.125	31%	0.311	C	S	.	.	H	α-helix	trans	-56.1	-46.2	178.7	171.8	-104.9	0	0	0	112.4	Q106 R143 L149 S150 S151	Q106-H147 PolarHBondContact OE1-NE2 3.24Å; R143-H147 WeakPolarHBondContact O-CB 3.38Å; R143-H147 PolarHBondContact O-N 3.22Å; H147-L149 VanDerWaalsContact C-N 3.34Å; H147-L149 PolarHBondContact O-N 3.18Å; H147-S150 PolarHBondContact O-N 3.05Å; H147-S151 VanDerWaalsContact O-CB 3.31Å; H147-S151 WeakPolarHBondContact O-CB 3.49Å; H147-S151 PolarHBondContact O-N 3.17Å; H147-S151 PolarHBondContact O-OG 3.07Å
148	K	97.4	Very high	95.9	Very high	121 Å²	121	61.8 Å²	61.8	53%	0.526	30%	0.302	S	S	.	.	H	α-helix	trans	-64.3	-36.4	-179.7	-176.4	178.4	-179.5	-179.2	0	112.9	N144 A145 I146 S151 R152	N144-K148 VanDerWaalsContact O-CB 3.29Å; N144-K148 WeakPolarHBondContact O-CB 3.39Å; N144-K148 PolarHBondContact O-N 3.4Å; A145-K148 PolarHBondContact O-N 3.49Å; I146-K148 VanDerWaalsContact C-N 3.34Å; I146-K148 PolarHBondContact O-N 3.01Å; K148-S151 PolarHBondContact O-OG 3.47Å; K148-R152 VanDerWaalsContact CE-NH2 3.31Å; K148-R152 WeakPolarHBondContact O-CD 3.31Å; K148-R152 WeakPolarHBondContact O-CG 3.43Å
149	L	97.2	Very high	96	Very high	58 Å²	58	60 Å²	60	30%	0.304	30%	0.299	S	S	.	.	H	α-helix	trans	-71.7	-51.4	176.1	-71.4	171.1	0	0	0	110.3	L117 F125 A145 I146 H147 S151 R152	L117-L149 HydrophobicContact CD2-CB 3.79Å; L117-L149 HydrophobicContact CD2-CD1 4.49Å; F125-L149 HydrophobicContact CE2-CD1 3.51Å; F125-L149 HydrophobicContact CZ-CD1 3.74Å; A145-L149 WeakPolarHBondContact O-CG 3.41Å; A145-L149 PolarHBondContact O-N 3.02Å; A145-L149 VanDerWaalsContact O-N 3.09Å; I146-L149 PolarHBondContact O-N 3.26Å; H147-L149 VanDerWaalsContact C-N 3.34Å; H147-L149 PolarHBondContact O-N 3.18Å; L149-S151 PolarHBondContact O-N 3.21Å; L149-R152 PolarHBondContact O-N 3.39Å
150	S	96.8	Very high	96	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-38.9	-177.7	-62.9	0	0	0	0	113.7	L116 I146 H147 R152 I153	L116-S150 WeakPolarHBondContact O-CA 3.48Å; L116-S150 WeakPolarHBondContact O-CB 3.47Å; L116-S150 PolarHBondContact O-OG 2.91Å; I146-S150 WeakPolarHBondContact O-CB 3.27Å; I146-S150 PolarHBondContact O-N 3.21Å; I146-S150 PolarHBondContact O-OG 3.47Å; H147-S150 PolarHBondContact O-N 3.05Å; S150-R152 PolarHBondContact O-N 2.74Å; S150-R152 VanDerWaalsContact O-N 3.09Å; S150-I153 PolarHBondContact O-N 3.05Å; S150-I153 VanDerWaalsContact O-N 3.08Å
151	S	95	Very high	96	Very high	51 Å²	51	55.4 Å²	55.4	36%	0.357	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-11.8	-179.8	68.2	0	0	0	0	114.1	H147 K148 L149	H147-S151 VanDerWaalsContact O-CB 3.31Å; H147-S151 WeakPolarHBondContact O-CB 3.49Å; H147-S151 PolarHBondContact O-N 3.17Å; H147-S151 PolarHBondContact O-OG 3.07Å; K148-S151 PolarHBondContact O-OG 3.47Å; L149-S151 PolarHBondContact O-N 3.21Å
152	R	94.6	Very high	95.8	Very high	162 Å²	162	53 Å²	53	61%	0.611	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-7.1	177	-66.6	173.6	178.7	-167.3	-6.9	113	K148 L149 S150	K148-R152 VanDerWaalsContact CE-NH2 3.31Å; K148-R152 WeakPolarHBondContact O-CD 3.31Å; K148-R152 WeakPolarHBondContact O-CG 3.43Å; L149-R152 PolarHBondContact O-N 3.39Å; S150-R152 PolarHBondContact O-N 2.74Å; S150-R152 VanDerWaalsContact O-N 3.09Å
153	I	95.1	Very high	95.7	Very high	38 Å²	38	51.8 Å²	51.8	20%	0.195	28%	0.275	C	S	.	.			trans	-92.7	108.5	-178.9	-59.6	-173.1	0	0	0	108.7	L116 P118 S150 V155	L116-I153 HydrophobicContact CB-CB 4.23Å; L116-I153 HydrophobicContact CB-CG2 4.41Å; L116-I153 WeakPolarHBondContact O-CD1 3.27Å; P118-I153 HydrophobicContact CG-CD1 4.19Å; S150-I153 PolarHBondContact O-N 3.05Å; S150-I153 VanDerWaalsContact O-N 3.08Å; I153-V155 WeakPolarHBondContact CG2-O 3.36Å
154	H	94	Very high	95.5	Very high	54 Å²	54	50.6 Å²	50.6	25%	0.25	27%	0.274	C	S	.	.			trans	-95.8	-11.1	-176.2	-57.3	-51.4	0	0	0	114.4	F162 N163 H182	H154-F162 CarbonylContact O-C 3.36Å; H154-F162 WeakPolarHBondContact O-CA 3.26Å; H154-N163 WeakPolarHBondContact CA-O 3.27Å; H154-N163 PolarHBondContact ND1-O 2.91Å; H154-N163 PolarHBondContact O-N 2.97Å; H154-H182 HydrophobicContact CB-CB 4.35Å; H154-H182 AromaticContact CD2-CD2 3.92Å; H154-H182 AromaticContact CD2-CG 3.75Å; H154-H182 AromaticContact CE1-CD2 3.1Å; H154-H182 PolarHBondContact CE1-CD2 3.28Å; H154-H182 AromaticContact CE1-CG 3.72Å; H154-H182 AromaticContact CE1-NE2 3.55Å; H154-H182 AromaticContact CG-CD2 3.97Å; H154-H182 AromaticContact ND1-CD2 3.48Å; H154-H182 PolarHBondContact ND1-CD2 3.04Å; H154-H182 AromaticContact NE2-CD2 3.39Å; H154-H182 PolarHBondContact NE2-CD2 3.13Å; H154-H182 AromaticContact NE2-CG 3.53Å; H154-H182 AromaticContact NE2-ND1 3.95Å; H154-H182 AromaticContact NE2-NE2 3.75Å
155	V	94.8	Very high	95.4	Very high	70 Å²	70	49.6 Å²	49.6	42%	0.424	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-122.9	123.3	173.8	-179.1	0	0	0	0	107.4	I153 F162	I153-V155 WeakPolarHBondContact CG2-O 3.36Å; V155-F162 HydrophobicContact CG2-CD1 3.98Å; V155-F162 HydrophobicContact CG2-CE1 3.62Å; V155-F162 HydrophobicContact CG2-CZ 4.25Å
156	C	96.2	Very high	95.3	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.007	26%	0.255	C	S	.	.			trans	-64.8	127.6	-177.6	-178	0	0	0	0	110.6	C109 C112 L116 F158 C159 S160 A161	C109-C156 HydrophobicContact CB-CB 4.35Å; C109-C156 VanDerWaalsContact SG-SG 3.65Å; C112-C156 VanDerWaalsContact SG-SG 3.65Å; L116-C156 HydrophobicContact CD2-CB 3.97Å; C156-F158 PolarHBondContact O-N 3.1Å; C156-F158 PolarHBondContact SG-N 3.2Å; C156-C159 VanDerWaalsContact SG-SG 3.6Å; C156-S160 VanDerWaalsContact O-CA 3.23Å; C156-S160 WeakPolarHBondContact O-CA 3.14Å; C156-S160 PolarHBondContact O-N 3.16Å; C156-A161 PolarHBondContact N-O 3.23Å
157	P	96.3	Very high	95.2	Very high	65 Å²	65	51 Å²	51	42%	0.422	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-10.7	179.3	26.7	-31.9	0	0	0	113.8
158	F	96.5	Very high	94.8	Very high	74 Å²	74	55 Å²	55	33%	0.325	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-39.9	-176.6	-59	-79.3	0	0	0	113.8	R114 V115 E119 C156	R114-F158 HydrophobicContact CB-CD2 3.58Å; R114-F158 HydrophobicContact CB-CE2 3.96Å; R114-F158 HydrophobicContact CB-CG 4.18Å; R114-F158 HydrophobicContact CG-CB 4.38Å; R114-F158 HydrophobicContact CG-CD2 4Å; R114-F158 HydrophobicContact CG-CG 4.08Å; V115-F158 WeakPolarHBondContact O-CE2 3.42Å; E119-F158 WeakPolarHBondContact OE2-CE1 3.28Å; C156-F158 PolarHBondContact O-N 3.1Å; C156-F158 PolarHBondContact SG-N 3.2Å
159	C	96.4	Very high	94.1	Very high	53 Å²	53	50.1 Å²	50.1	36%	0.358	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	2.6	-176.7	71.2	0	0	0	0	114	C109 C112 C156 A161	C109-C159 VanDerWaalsContact SG-SG 3.63Å; C112-C159 HydrophobicContact CB-CB 4.08Å; C156-C159 VanDerWaalsContact SG-SG 3.6Å; C159-A161 PolarHBondContact O-N 3.04Å; C159-A161 VanDerWaalsContact SG-CB 3.56Å
160	S	94.2	Very high	93	Very high	84 Å²	84	56.9 Å²	56.9	59%	0.587	31%	0.308	S	S	*	.			trans	61.6	6.5	179.9	-52.9	0	0	0	0	116	C156	C156-S160 VanDerWaalsContact O-CA 3.23Å; C156-S160 WeakPolarHBondContact O-CA 3.14Å; C156-S160 PolarHBondContact O-N 3.16Å
161	A	93.1	Very high	92	Very high	21 Å²	21	59.3 Å²	59.3	17%	0.174	33%	0.325	C	S	.	.			trans	-67.7	146.5	176.8	0	0	0	0	0	112.4	T111 C156 C159 N163	T111-A161 HydrophobicContact CG2-CB 4.32Å; T111-A161 VanDerWaalsContact OG1-CB 3.25Å; T111-A161 WeakPolarHBondContact OG1-CB 3.36Å; C156-A161 PolarHBondContact N-O 3.23Å; C159-A161 PolarHBondContact O-N 3.04Å; C159-A161 VanDerWaalsContact SG-CB 3.56Å; A161-N163 PolarHBondContact O-ND2 3.46Å
162	F	92.1	Very high	90.8	Very high	61 Å²	61	57.8 Å²	57.8	27%	0.268	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-76.3	135.4	177.5	-71.3	-86	0	0	0	111.9	H154 V155 A183 K186	H154-F162 CarbonylContact O-C 3.36Å; H154-F162 WeakPolarHBondContact O-CA 3.26Å; V155-F162 HydrophobicContact CG2-CD1 3.98Å; V155-F162 HydrophobicContact CG2-CE1 3.62Å; V155-F162 HydrophobicContact CG2-CZ 4.25Å; F162-A183 HydrophobicContact CD1-CB 3.67Å; F162-A183 HydrophobicContact CE1-CB 4.01Å; F162-A183 HydrophobicContact CG-CB 4.41Å; F162-K186 HydrophobicContact CD2-CD 3.87Å; F162-K186 HydrophobicContact CE1-CD 4.26Å; F162-K186 HydrophobicContact CE2-CD 3.28Å; F162-K186 HydrophobicContact CZ-CD 3.51Å
163	N	94	Very high	89.9	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	29%	0.287	C	S	.	.			trans	-131.1	84.8	-177.2	-75.1	-88.6	0	0	0	108.8	C109 K110 L116 H154 A161	C109-N163 WeakPolarHBondContact CA-OD1 3.44Å; C109-N163 PolarHBondContact SG-ND2 3.34Å; C109-N163 VanDerWaalsContact SG-ND2 3.43Å; K110-N163 WeakPolarHBondContact CD-OD1 3.36Å; K110-N163 PolarHBondContact N-OD1 2.84Å; L116-N163 HydrophobicContact CD1-CB 3.97Å; H154-N163 WeakPolarHBondContact CA-O 3.27Å; H154-N163 PolarHBondContact ND1-O 2.91Å; H154-N163 PolarHBondContact O-N 2.97Å; A161-N163 PolarHBondContact O-ND2 3.46Å
164	G	92.7	Very high	89.3	Confident	9 Å²	9	51 Å²	51	9%	0.093	29%	0.287	C	S	.	.			trans	-72.1	-159.6	170.9	0	0	0	0	0	113.7	H177 D178 I179	G164-H177 PolarHBondContact N-NE2 3.25Å; G164-D178 CarbonylContact C-O 3.49Å; G164-D178 WeakPolarHBondContact CA-O 3.18Å; G164-I179 WeakPolarHBondContact CA-O 3.43Å; G164-I179 PolarHBondContact N-O 2.9Å
165	V	94.1	Very high	89.3	Confident	50 Å²	50	48.4 Å²	48.4	30%	0.303	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.4	-168.2	178.5	0	0	0	0	110.6	T167 H177 D178 R181 H182	V165-T167 HydrophobicContact CG1-CG2 4.04Å; V165-H177 CarbonylContact O-C 3.55Å; V165-H177 WeakPolarHBondContact O-CA 3.33Å; V165-D178 PolarHBondContact N-O 3.08Å; V165-D178 PolarHBondContact O-N 3.24Å; V165-R181 HydrophobicContact CG2-CB 4.12Å; V165-R181 HydrophobicContact CG2-CG 3.88Å; V165-H182 VanDerWaalsContact CG2-NE2 3.3Å; V165-H182 WeakPolarHBondContact CG2-NE2 3.34Å
166	V	95.9	Very high	89.3	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131	171.7	-179.3	0	0	0	0	109.8	L105 Q106 V175 V176 H177	L105-V166 HydrophobicContact CB-CG1 4.15Å; Q106-V166 HydrophobicContact CG-CB 3.82Å; Q106-V166 HydrophobicContact CG-CG1 4.47Å; Q106-V166 PolarHBondContact NE2-O 3.38Å; V166-V175 HydrophobicContact CG1-CG1 3.37Å; V166-V176 CarbonylContact C-O 3.58Å; V166-V176 VanDerWaalsContact CA-O 3.28Å; V166-V176 WeakPolarHBondContact CA-O 3.49Å; V166-H177 HydrophobicContact CG2-CB 4.14Å
167	T	94.5	Very high	89.2	Confident	68 Å²	68	46.7 Å²	46.7	42%	0.417	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	152.2	179.2	45.7	0	0	0	0	111.2	V165 V176	V165-T167 HydrophobicContact CG1-CG2 4.04Å; T167-V176 PolarHBondContact N-O 2.87Å; T167-V176 PolarHBondContact O-N 2.87Å
168	K	90.4	Very high	89.1	Confident	111 Å²	111	45 Å²	45	48%	0.483	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	131.1	165.8	-170	-171.3	169.5	-174.4	0	108.5	T98 V102	T98-K168 HydrophobicContact CG2-CD 4.28Å; T98-K168 HydrophobicContact CG2-CG 4.39Å; V102-K168 HydrophobicContact CG2-CB 4.26Å
169	G	82.8	Confident	88.7	Confident	18 Å²	18	42.7 Å²	42.7	19%	0.186	24%	0.242	C	C	.	.			trans	-70.9	175.8	172.5	0	0	0	0	0	112.5	Y174	G169-Y174 WeakPolarHBondContact CA-O 3.35Å; G169-Y174 PolarHBondContact N-O 3.27Å
170	M	74.7	Confident	88.2	Confident	199 Å²	199	41.1 Å²	41.1	98%	0.98	23%	0.229	S	C	*	.	S	Bend	trans	-70.3	-36.8	-177.8	-67.5	178.5	66.8	0	0	112.5
171	S	74.1	Confident	87.8	Confident	52 Å²	52	44.5 Å²	44.5	36%	0.364	23%	0.229	S	C	.	.	S	Bend	trans	-96.1	161	178.3	34.7	0	0	0	0	112.1	P173 Y174	S171-P173 VanDerWaalsContact C-CD 3.49Å; S171-Y174 PolarHBondContact O-N 2.82Å; S171-Y174 WeakPolarHBondContact OG-CD2 3.38Å; S171-Y174 WeakPolarHBondContact OG-CE2 3.43Å
172	L	71.5	Confident	87.5	Confident	18 Å²	18	48.6 Å²	48.6	9%	0.094	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-42.2	-170.7	-65.4	171.5	0	0	0	115.5	V95 A314 Q321 L324	V95-L172 HydrophobicContact CG2-CD2 4.47Å; L172-A314 HydrophobicContact CD1-CB 3.92Å; L172-Q321 HydrophobicContact CD2-CG 4.02Å; L172-L324 HydrophobicContact CD1-CD2 3.53Å; L172-L324 HydrophobicContact CD1-CG 4.18Å
173	P	73.7	Confident	87.1	Confident	11 Å²	11	46.3 Å²	46.3	7%	0.071	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	4	-173.6	32.2	-30.4	0	0	0	115	Y93 S171 D307 H310	Y93-P173 WeakPolarHBondContact CD2-O 3.37Å; Y93-P173 WeakPolarHBondContact CE2-O 2.9Å; S171-P173 VanDerWaalsContact C-CD 3.49Å; P173-D307 WeakPolarHBondContact CG-OD1 3.17Å; P173-H310 HydrophobicContact CB-CB 4.18Å; P173-H310 HydrophobicContact CG-CB 4.38Å
174	Y	83.7	Confident	86.6	Confident	47 Å²	47	54.2 Å²	54.2	18%	0.184	27%	0.271	C	S	.	.			trans	-98.9	123.5	-170.2	-65.5	-92.1	0	0	0	111.5	G169 S171 I214 D307	G169-Y174 WeakPolarHBondContact CA-O 3.35Å; G169-Y174 PolarHBondContact N-O 3.27Å; S171-Y174 PolarHBondContact O-N 2.82Å; S171-Y174 WeakPolarHBondContact OG-CD2 3.38Å; S171-Y174 WeakPolarHBondContact OG-CE2 3.43Å; Y174-I214 HydrophobicContact CD1-CD1 4.14Å; Y174-I214 HydrophobicContact CD1-CG2 3.75Å; Y174-I214 HydrophobicContact CE1-CD1 4.22Å; Y174-I214 HydrophobicContact CE1-CG2 4.29Å; Y174-D307 WeakPolarHBondContact CE2-OD1 3.5Å; Y174-D307 WeakPolarHBondContact CE2-OD2 3.45Å; Y174-D307 PolarHBondContact OH-OD1 3.02Å; Y174-D307 PolarHBondContact OH-OD2 3.43Å
175	V	93.6	Very high	86	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.8	163.1	179.4	0	0	0	0	106.6	Y93 V102 L105 V166 I215	Y93-V175 HydrophobicContact CE2-CG2 3.84Å; V102-V175 HydrophobicContact CG2-CG1 4.2Å; V102-V175 HydrophobicContact CG2-CG2 3.81Å; L105-V175 HydrophobicContact CD1-CB 4.46Å; L105-V175 HydrophobicContact CD1-CG1 3.8Å; V166-V175 HydrophobicContact CG1-CG1 3.37Å; V175-I215 HydrophobicContact CB-CB 4.36Å; V175-I215 HydrophobicContact CG1-CB 4.44Å; V175-I215 PolarHBondContact O-N 3.11Å
176	V	94.4	Very high	85.4	Confident	30 Å²	30	59.3 Å²	59.3	18%	0.182	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.3	-174.7	-177.7	0	0	0	0	109.1	V166 T167 L212 E213	V166-V176 CarbonylContact C-O 3.58Å; V166-V176 VanDerWaalsContact CA-O 3.28Å; V166-V176 WeakPolarHBondContact CA-O 3.49Å; T167-V176 PolarHBondContact N-O 2.87Å; T167-V176 PolarHBondContact O-N 2.87Å; V176-L212 HydrophobicContact CG1-CB 4.34Å; V176-L212 HydrophobicContact CG1-CD2 3.89Å; V176-E213 CarbonylContact C-O 2.99Å; V176-E213 WeakPolarHBondContact CA-O 3.43Å
177	H	94.8	Very high	84.9	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.019	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	107.7	173.4	-177.5	-160.3	0	0	0	109.1	G164 V165 V166 I179 E213 I215	G164-H177 PolarHBondContact N-NE2 3.25Å; V165-H177 CarbonylContact O-C 3.55Å; V165-H177 WeakPolarHBondContact O-CA 3.33Å; V166-H177 HydrophobicContact CG2-CB 4.14Å; H177-I179 PolarHBondContact O-N 3.08Å; H177-E213 HydrophobicContact CB-CB 4.4Å; H177-E213 PolarHBondContact N-O 2.99Å; H177-E213 PolarHBondContact O-N 3.25Å; H177-I215 HydrophobicContact CB-CD1 3.87Å; H177-I215 HydrophobicContact CB-CG1 4.08Å
178	D	93	Very high	84.5	Confident	29 Å²	29	61.2 Å²	61.2	16%	0.155	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	91.7	170.2	-178.1	-18.6	0	0	0	107.9	G164 V165 F180 R181 L212	G164-D178 CarbonylContact C-O 3.49Å; G164-D178 WeakPolarHBondContact CA-O 3.18Å; V165-D178 PolarHBondContact N-O 3.08Å; V165-D178 PolarHBondContact O-N 3.24Å; D178-F180 PolarHBondContact O-N 3.06Å; D178-R181 HydrophobicContact CB-CB 4.32Å; D178-R181 WeakPolarHBondContact OD1-CA 3.45Å; D178-R181 WeakPolarHBondContact OD1-CB 3.4Å; D178-R181 PolarHBondContact OD1-N 2.82Å; D178-R181 WeakPolarHBondContact OD2-CD 3.34Å; D178-R181 IonicContact OD2-NH1 2.78Å; D178-L212 HydrophobicContact CB-CD2 3.75Å
179	I	89.7	Confident	84.3	Confident	27 Å²	27	61.5 Å²	61.5	14%	0.138	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-42.6	-169.6	-60.7	163.2	0	0	0	110.8	G164 H177 G211 E213	G164-I179 WeakPolarHBondContact CA-O 3.43Å; G164-I179 PolarHBondContact N-O 2.9Å; H177-I179 PolarHBondContact O-N 3.08Å; I179-G211 PolarHBondContact N-O 2.63Å; I179-G211 VanDerWaalsContact N-O 3.07Å; I179-E213 HydrophobicContact CD1-CB 3.97Å; I179-E213 HydrophobicContact CG1-CB 4.49Å
180	F	86	Confident	84.4	Confident	20 Å²	20	63.3 Å²	63.3	9%	0.088	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	10.1	-169.9	-56.1	-68.2	0	0	0	114.4	D178 H182 A183 K184 K186 V187 Y190	D178-F180 PolarHBondContact O-N 3.06Å; F180-H182 PolarHBondContact O-N 2.76Å; F180-A183 HydrophobicContact CD1-CB 4.37Å; F180-A183 CarbonylContact O-C 3.58Å; F180-A183 PolarHBondContact O-N 2.96Å; F180-K184 PolarHBondContact O-N 3Å; F180-K186 HydrophobicContact CD1-CB 4.26Å; F180-K186 HydrophobicContact CE1-CB 4.2Å; F180-V187 HydrophobicContact CB-CG2 3.45Å; F180-V187 VanDerWaalsContact CB-CG2 3.45Å; F180-V187 HydrophobicContact CD1-CG2 4.49Å; F180-V187 HydrophobicContact CD2-CG2 4.19Å; F180-V187 HydrophobicContact CG-CG2 3.81Å; F180-Y190 HydrophobicContact CD2-CD1 4.36Å; F180-Y190 HydrophobicContact CD2-CG 4.5Å; F180-Y190 AromaticContact CE2-CD1 3.48Å; F180-Y190 HydrophobicContact CE2-CD1 3.48Å; F180-Y190 VanDerWaalsContact CE2-CD1 3.48Å; F180-Y190 AromaticContact CE2-CD2 3.8Å; F180-Y190 HydrophobicContact CE2-CD2 3.8Å; F180-Y190 HydrophobicContact CE2-CE1 4.01Å; F180-Y190 HydrophobicContact CE2-CE2 4.27Å; F180-Y190 AromaticContact CE2-CG 3.35Å; F180-Y190 HydrophobicContact CE2-CG 3.35Å; F180-Y190 VanDerWaalsContact CZ-CB 3.48Å; F180-Y190 HydrophobicContact CZ-CD1 4.13Å; F180-Y190 AromaticContact CZ-CD2 3.69Å; F180-Y190 HydrophobicContact CZ-CD2 3.69Å; F180-Y190 HydrophobicContact CZ-CE2 4.43Å; F180-Y190 AromaticContact CZ-CG 3.49Å; F180-Y190 HydrophobicContact CZ-CG 3.49Å; F180-Y190 VanDerWaalsContact CZ-CG 3.49Å
181	R	86.2	Confident	85	Confident	155 Å²	155	54.6 Å²	54.6	59%	0.585	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.5	-43.6	174.4	-169.5	74.2	-171.1	-176.2	-0.8	113.6	V165 D178	V165-R181 HydrophobicContact CG2-CB 4.12Å; V165-R181 HydrophobicContact CG2-CG 3.88Å; D178-R181 HydrophobicContact CB-CB 4.32Å; D178-R181 WeakPolarHBondContact OD1-CA 3.45Å; D178-R181 WeakPolarHBondContact OD1-CB 3.4Å; D178-R181 PolarHBondContact OD1-N 2.82Å; D178-R181 WeakPolarHBondContact OD2-CD 3.34Å; D178-R181 IonicContact OD2-NH1 2.78Å
182	H	85.3	Confident	85.7	Confident	106 Å²	106	57.5 Å²	57.5	49%	0.491	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	8.1	-176.8	-60	-69.8	0	0	0	113.7	H154 V165 F180	H154-H182 HydrophobicContact CB-CB 4.35Å; H154-H182 AromaticContact CD2-CD2 3.92Å; H154-H182 AromaticContact CD2-CG 3.75Å; H154-H182 AromaticContact CE1-CD2 3.1Å; H154-H182 PolarHBondContact CE1-CD2 3.28Å; H154-H182 AromaticContact CE1-CG 3.72Å; H154-H182 AromaticContact CE1-NE2 3.55Å; H154-H182 AromaticContact CG-CD2 3.97Å; H154-H182 AromaticContact ND1-CD2 3.48Å; H154-H182 PolarHBondContact ND1-CD2 3.04Å; H154-H182 AromaticContact NE2-CD2 3.39Å; H154-H182 PolarHBondContact NE2-CD2 3.13Å; H154-H182 AromaticContact NE2-CG 3.53Å; H154-H182 AromaticContact NE2-ND1 3.95Å; H154-H182 AromaticContact NE2-NE2 3.75Å; V165-H182 VanDerWaalsContact CG2-NE2 3.3Å; V165-H182 WeakPolarHBondContact CG2-NE2 3.34Å; F180-H182 PolarHBondContact O-N 2.76Å
183	A	84.4	Confident	86.5	Confident	14 Å²	14	63.9 Å²	63.9	12%	0.116	32%	0.315	C	S	.	.			trans	-136.5	48.8	-176	0	0	0	0	0	111.2	F162 F180 A185 K186	F162-A183 HydrophobicContact CD1-CB 3.67Å; F162-A183 HydrophobicContact CE1-CB 4.01Å; F162-A183 HydrophobicContact CG-CB 4.41Å; F180-A183 HydrophobicContact CD1-CB 4.37Å; F180-A183 CarbonylContact O-C 3.58Å; F180-A183 PolarHBondContact O-N 2.96Å; A183-A185 PolarHBondContact O-N 2.7Å; A183-A185 VanDerWaalsContact O-N 3.14Å; A183-K186 PolarHBondContact O-N 3.42Å
184	K	82.2	Confident	87.2	Confident	169 Å²	169	66.7 Å²	66.7	74%	0.735	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-55.2	-33.5	-175.8	-68.7	-173.6	178.2	-178	0	113.8	F180 K186 V187	F180-K184 PolarHBondContact O-N 3Å; K184-K186 PolarHBondContact O-N 3.39Å; K184-V187 WeakPolarHBondContact O-CB 3.44Å; K184-V187 WeakPolarHBondContact O-CG2 3.28Å; K184-V187 PolarHBondContact O-N 3.09Å; K184-V187 VanDerWaalsContact O-N 3.16Å
185	A	80.6	Confident	87.5	Confident	91 Å²	91	66.7 Å²	66.7	75%	0.752	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-63.3	-19.6	179.2	0	0	0	0	0	113.9	A183	A183-A185 PolarHBondContact O-N 2.7Å; A183-A185 VanDerWaalsContact O-N 3.14Å
186	K	82.7	Confident	87.3	Confident	75 Å²	75	75.1 Å²	75.1	33%	0.326	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-97.7	-0.7	178.7	-66.5	-151.7	168.7	-140.3	0	114.3	F162 F180 A183 K184 D188 E189 Y190	F162-K186 HydrophobicContact CD2-CD 3.87Å; F162-K186 HydrophobicContact CE1-CD 4.26Å; F162-K186 HydrophobicContact CE2-CD 3.28Å; F162-K186 HydrophobicContact CZ-CD 3.51Å; F180-K186 HydrophobicContact CD1-CB 4.26Å; F180-K186 HydrophobicContact CE1-CB 4.2Å; A183-K186 PolarHBondContact O-N 3.42Å; K184-K186 PolarHBondContact O-N 3.39Å; K186-D188 VanDerWaalsContact C-N 3.26Å; K186-D188 PolarHBondContact O-N 3.15Å; K186-E189 IonicContact NZ-OE2 2.89Å; K186-E189 PolarHBondContact O-N 3.01Å; K186-Y190 PolarHBondContact O-N 2.9Å
187	V	85.1	Confident	87.1	Confident	22 Å²	22	77.2 Å²	77.2	13%	0.133	39%	0.385	C	S	.	.	H	α-helix	trans	-63.5	-39	179.7	174.4	0	0	0	0	110.2	F180 K184 Y190 V191 R209	F180-V187 HydrophobicContact CB-CG2 3.45Å; F180-V187 VanDerWaalsContact CB-CG2 3.45Å; F180-V187 HydrophobicContact CD1-CG2 4.49Å; F180-V187 HydrophobicContact CD2-CG2 4.19Å; F180-V187 HydrophobicContact CG-CG2 3.81Å; K184-V187 WeakPolarHBondContact O-CB 3.44Å; K184-V187 WeakPolarHBondContact O-CG2 3.28Å; K184-V187 PolarHBondContact O-N 3.09Å; K184-V187 VanDerWaalsContact O-N 3.16Å; V187-Y190 PolarHBondContact O-N 3.31Å; V187-V191 HydrophobicContact CG1-CG2 3.95Å; V187-V191 WeakPolarHBondContact O-CB 3.41Å; V187-V191 WeakPolarHBondContact O-CG2 3.17Å; V187-V191 PolarHBondContact O-N 3.35Å; V187-R209 HydrophobicContact CG1-CB 4.45Å; V187-R209 HydrophobicContact CG1-CG 4.23Å; V187-R209 WeakPolarHBondContact CG1-O 3.19Å
188	D	85.1	Confident	86.9	Confident	87 Å²	87	78.2 Å²	78.2	47%	0.465	39%	0.391	S	S	.	.	H	α-helix	trans	-65.6	-45.5	-178.6	-62.4	-40.2	0	0	0	111.3	K186 Y190 V191 D192	K186-D188 VanDerWaalsContact C-N 3.26Å; K186-D188 PolarHBondContact O-N 3.15Å; D188-Y190 VanDerWaalsContact C-N 3.26Å; D188-Y190 PolarHBondContact O-N 3.24Å; D188-V191 PolarHBondContact O-N 3.47Å; D188-V191 VanDerWaalsContact O-N 3.13Å; D188-D192 VanDerWaalsContact O-CG 3.3Å; D188-D192 PolarHBondContact O-N 3.07Å
189	E	86.6	Confident	86.8	Confident	118 Å²	118	82.3 Å²	82.3	55%	0.551	42%	0.417	S	S	*	.	H	α-helix	trans	-53.4	-44.2	173	-67.2	176.2	-174.5	0	0	111.6	K186 E193	K186-E189 IonicContact NZ-OE2 2.89Å; K186-E189 PolarHBondContact O-N 3.01Å; E189-E193 PolarHBondContact O-N 3.11Å
190	Y	85.4	Confident	86.9	Confident	56 Å²	56	90.2 Å²	90.2	22%	0.22	45%	0.45	C	S	.	.	H	α-helix	trans	-69.8	-40	178.6	177.7	-101.4	0	0	0	112.9	F180 K186 V187 D188 D192 E193 F194 V208	F180-Y190 HydrophobicContact CD2-CD1 4.36Å; F180-Y190 HydrophobicContact CD2-CG 4.5Å; F180-Y190 AromaticContact CE2-CD1 3.48Å; F180-Y190 HydrophobicContact CE2-CD1 3.48Å; F180-Y190 VanDerWaalsContact CE2-CD1 3.48Å; F180-Y190 AromaticContact CE2-CD2 3.8Å; F180-Y190 HydrophobicContact CE2-CD2 3.8Å; F180-Y190 HydrophobicContact CE2-CE1 4.01Å; F180-Y190 HydrophobicContact CE2-CE2 4.27Å; F180-Y190 AromaticContact CE2-CG 3.35Å; F180-Y190 HydrophobicContact CE2-CG 3.35Å; F180-Y190 VanDerWaalsContact CZ-CB 3.48Å; F180-Y190 HydrophobicContact CZ-CD1 4.13Å; F180-Y190 AromaticContact CZ-CD2 3.69Å; F180-Y190 HydrophobicContact CZ-CD2 3.69Å; F180-Y190 HydrophobicContact CZ-CE2 4.43Å; F180-Y190 AromaticContact CZ-CG 3.49Å; F180-Y190 HydrophobicContact CZ-CG 3.49Å; F180-Y190 VanDerWaalsContact CZ-CG 3.49Å; K186-Y190 PolarHBondContact O-N 2.9Å; V187-Y190 PolarHBondContact O-N 3.31Å; D188-Y190 VanDerWaalsContact C-N 3.26Å; D188-Y190 PolarHBondContact O-N 3.24Å; Y190-D192 VanDerWaalsContact C-N 3.26Å; Y190-D192 PolarHBondContact O-N 3.22Å; Y190-E193 WeakPolarHBondContact O-CB 3.45Å; Y190-E193 PolarHBondContact O-N 3.15Å; Y190-F194 HydrophobicContact CD1-CE2 4.47Å; Y190-F194 HydrophobicContact CD2-CE2 4.27Å; Y190-F194 HydrophobicContact CE1-CD2 4.28Å; Y190-F194 AromaticContact CE1-CE2 3.89Å; Y190-F194 HydrophobicContact CE1-CE2 3.89Å; Y190-F194 AromaticContact CE2-CE2 3.67Å; Y190-F194 HydrophobicContact CE2-CE2 3.67Å; Y190-F194 HydrophobicContact CE2-CZ 4.44Å; Y190-F194 AromaticContact CZ-CE2 3.45Å; Y190-F194 VanDerWaalsContact CZ-CE2 3.45Å; Y190-F194 WeakPolarHBondContact O-CD2 3.41Å; Y190-V208 HydrophobicContact CD1-CG1 4.17Å; Y190-V208 HydrophobicContact CE1-CG1 3.9Å
191	V	87.1	Confident	87.1	Confident	15 Å²	15	92.6 Å²	92.6	9%	0.091	46%	0.464	C	S	.	.	H	α-helix	trans	-65.5	-35.4	178.8	171.8	0	0	0	0	110.7	V187 D188 E193 F194 A195 I198 V208 R209	V187-V191 HydrophobicContact CG1-CG2 3.95Å; V187-V191 WeakPolarHBondContact O-CB 3.41Å; V187-V191 WeakPolarHBondContact O-CG2 3.17Å; V187-V191 PolarHBondContact O-N 3.35Å; D188-V191 PolarHBondContact O-N 3.47Å; D188-V191 VanDerWaalsContact O-N 3.13Å; V191-E193 VanDerWaalsContact C-N 3.29Å; V191-E193 PolarHBondContact O-N 3.35Å; V191-F194 CarbonylContact O-C 3.59Å; V191-F194 PolarHBondContact O-N 2.74Å; V191-A195 PolarHBondContact O-N 3.11Å; V191-I198 HydrophobicContact CG1-CD1 3.8Å; V191-V208 HydrophobicContact CG2-CG1 4.14Å; V191-R209 HydrophobicContact CG1-CG 4.45Å; V191-R209 HydrophobicContact CG2-CB 4.3Å; V191-R209 HydrophobicContact CG2-CG 3.46Å; V191-R209 VanDerWaalsContact CG2-CG 3.46Å
192	D	88.5	Confident	87.2	Confident	114 Å²	114	90.4 Å²	90.4	61%	0.61	47%	0.468	S	S	*	.	H	α-helix	trans	-64.2	-31.6	177.2	-72.7	-17.7	0	0	0	112.4	D188 Y190 F194 A195	D188-D192 VanDerWaalsContact O-CG 3.3Å; D188-D192 PolarHBondContact O-N 3.07Å; Y190-D192 VanDerWaalsContact C-N 3.26Å; Y190-D192 PolarHBondContact O-N 3.22Å; D192-F194 PolarHBondContact O-N 3.18Å; D192-A195 WeakPolarHBondContact O-CB 3.46Å; D192-A195 PolarHBondContact O-N 2.62Å
193	E	88.8	Confident	87.4	Confident	152 Å²	152	92.5 Å²	92.5	71%	0.71	48%	0.478	S	S	*	.	H	α-helix	trans	-59.3	-29.1	171.9	-64.9	-177.7	171.2	0	0	112.2	E189 Y190 V191	E189-E193 PolarHBondContact O-N 3.11Å; Y190-E193 WeakPolarHBondContact O-CB 3.45Å; Y190-E193 PolarHBondContact O-N 3.15Å; V191-E193 VanDerWaalsContact C-N 3.29Å; V191-E193 PolarHBondContact O-N 3.35Å
194	F	89.1	Confident	87.7	Confident	70 Å²	70	94.6 Å²	94.6	31%	0.307	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	7.1	178	-66.1	-88.6	0	0	0	113.7	Y190 V191 D192 K196 V197 I198 V208	Y190-F194 HydrophobicContact CD1-CE2 4.47Å; Y190-F194 HydrophobicContact CD2-CE2 4.27Å; Y190-F194 HydrophobicContact CE1-CD2 4.28Å; Y190-F194 AromaticContact CE1-CE2 3.89Å; Y190-F194 HydrophobicContact CE1-CE2 3.89Å; Y190-F194 AromaticContact CE2-CE2 3.67Å; Y190-F194 HydrophobicContact CE2-CE2 3.67Å; Y190-F194 HydrophobicContact CE2-CZ 4.44Å; Y190-F194 AromaticContact CZ-CE2 3.45Å; Y190-F194 VanDerWaalsContact CZ-CE2 3.45Å; Y190-F194 WeakPolarHBondContact O-CD2 3.41Å; V191-F194 CarbonylContact O-C 3.59Å; V191-F194 PolarHBondContact O-N 2.74Å; D192-F194 PolarHBondContact O-N 3.18Å; F194-K196 PolarHBondContact O-N 3.44Å; F194-K196 VanDerWaalsContact O-N 3.08Å; F194-V197 PolarHBondContact O-N 3.29Å; F194-I198 HydrophobicContact CB-CD1 4.01Å; F194-I198 HydrophobicContact CB-CG1 4.28Å; F194-I198 WeakPolarHBondContact O-CG1 3.06Å; F194-I198 PolarHBondContact O-N 3.45Å; F194-V208 HydrophobicContact CB-CG1 4.02Å; F194-V208 HydrophobicContact CB-CG2 4.34Å; F194-V208 HydrophobicContact CD2-CG1 3.7Å; F194-V208 HydrophobicContact CE2-CG1 4.46Å; F194-V208 HydrophobicContact CG-CG1 3.96Å; F194-V208 HydrophobicContact CG-CG2 4.37Å
195	A	88.7	Confident	87.8	Confident	47 Å²	47	87.9 Å²	87.9	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-52.7	-38.9	-175.3	0	0	0	0	0	112.9	V191 D192 V197 I198 T199	V191-A195 PolarHBondContact O-N 3.11Å; D192-A195 WeakPolarHBondContact O-CB 3.46Å; D192-A195 PolarHBondContact O-N 2.62Å; A195-V197 VanDerWaalsContact C-N 3.35Å; A195-V197 PolarHBondContact O-N 3.05Å; A195-I198 PolarHBondContact O-N 2.98Å; A195-T199 PolarHBondContact O-N 2.85Å; A195-T199 PolarHBondContact O-OG1 2.84Å
196	K	90.3	Very high	88.2	Confident	177 Å²	177	87.3 Å²	87.3	77%	0.77	45%	0.451	S	S	*	.	H	α-helix	trans	-64.4	-33.3	177.1	-69.2	-178.2	-179	174.9	0	114.1	F194 T199	F194-K196 PolarHBondContact O-N 3.44Å; F194-K196 VanDerWaalsContact O-N 3.08Å; K196-T199 WeakPolarHBondContact CA-OG1 3.21Å; K196-T199 PolarHBondContact O-OG1 3.44Å
197	V	89.3	Confident	88.4	Confident	73 Å²	73	87.9 Å²	87.9	44%	0.442	46%	0.461	S	S	.	.	H	α-helix	trans	-83.8	-40.3	-179.7	-177.4	0	0	0	0	109.5	F194 A195 T199 K200 N201 L204	F194-V197 PolarHBondContact O-N 3.29Å; A195-V197 VanDerWaalsContact C-N 3.35Å; A195-V197 PolarHBondContact O-N 3.05Å; V197-T199 VanDerWaalsContact C-N 3.27Å; V197-T199 PolarHBondContact O-N 3.16Å; V197-K200 WeakPolarHBondContact O-CB 2.79Å; V197-K200 PolarHBondContact O-N 2.86Å; V197-N201 PolarHBondContact O-N 3.24Å; V197-L204 HydrophobicContact CG1-CD1 3.71Å
198	I	90	Very high	88.4	Confident	26 Å²	26	88 Å²	88	13%	0.133	46%	0.461	C	S	.	.	H	α-helix	trans	-61.9	-35.7	176.1	-66.7	168.5	0	0	0	111.3	V191 F194 A195 K200 N201 T202 A205 V208	V191-I198 HydrophobicContact CG1-CD1 3.8Å; F194-I198 HydrophobicContact CB-CD1 4.01Å; F194-I198 HydrophobicContact CB-CG1 4.28Å; F194-I198 WeakPolarHBondContact O-CG1 3.06Å; F194-I198 PolarHBondContact O-N 3.45Å; A195-I198 PolarHBondContact O-N 2.98Å; I198-K200 VanDerWaalsContact C-N 3.27Å; I198-K200 PolarHBondContact O-N 3.44Å; I198-N201 CarbonylContact O-C 3.53Å; I198-N201 PolarHBondContact O-N 2.87Å; I198-T202 WeakPolarHBondContact O-CA 3.5Å; I198-T202 PolarHBondContact O-N 3.02Å; I198-A205 HydrophobicContact CG2-CB 3.77Å; I198-V208 HydrophobicContact CD1-CB 4.38Å; I198-V208 HydrophobicContact CD1-CG1 4.45Å; I198-V208 HydrophobicContact CD1-CG2 4.44Å
199	T	91	Very high	88.5	Confident	114 Å²	114	90.8 Å²	90.8	70%	0.699	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-28.6	174.2	20.9	0	0	0	0	113.1	A195 K196 V197	A195-T199 PolarHBondContact O-N 2.85Å; A195-T199 PolarHBondContact O-OG1 2.84Å; K196-T199 WeakPolarHBondContact CA-OG1 3.21Å; K196-T199 PolarHBondContact O-OG1 3.44Å; V197-T199 VanDerWaalsContact C-N 3.27Å; V197-T199 PolarHBondContact O-N 3.16Å
200	K	92.4	Very high	88.5	Confident	193 Å²	193	91.4 Å²	91.4	84%	0.839	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-34.5	175.5	-68.7	-176.7	178.8	-175	0	112.8	V197 I198	V197-K200 WeakPolarHBondContact O-CB 2.79Å; V197-K200 PolarHBondContact O-N 2.86Å; I198-K200 VanDerWaalsContact C-N 3.27Å; I198-K200 PolarHBondContact O-N 3.44Å
201	N	90.5	Very high	88.4	Confident	71 Å²	71	88.9 Å²	88.9	38%	0.38	46%	0.457	S	S	.	.			trans	-140.3	100.3	175.8	-175	-9	0	0	0	109.8	V197 I198 E203 L204	V197-N201 PolarHBondContact O-N 3.24Å; I198-N201 CarbonylContact O-C 3.53Å; I198-N201 PolarHBondContact O-N 2.87Å; N201-E203 PolarHBondContact O-N 3.5Å; N201-E203 WeakPolarHBondContact OD1-CB 3.11Å; N201-E203 PolarHBondContact OD1-N 3.26Å; N201-L204 HydrophobicContact CB-CD1 3.96Å; N201-L204 HydrophobicContact CB-CG 4.16Å; N201-L204 WeakPolarHBondContact O-CB 3.36Å; N201-L204 PolarHBondContact O-N 2.99Å; N201-L204 VanDerWaalsContact O-N 3.17Å
202	T	88.8	Confident	88.5	Confident	108 Å²	108	92.4 Å²	92.4	66%	0.663	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-65.9	-22	-175	46.9	0	0	0	0	113	I198 L204 A205	I198-T202 WeakPolarHBondContact O-CA 3.5Å; I198-T202 PolarHBondContact O-N 3.02Å; T202-L204 PolarHBondContact O-N 3.04Å; T202-A205 WeakPolarHBondContact O-CB 3.4Å; T202-A205 PolarHBondContact O-N 3.41Å
203	E	89.8	Confident	88.6	Confident	150 Å²	150	89.7 Å²	89.7	70%	0.701	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-66.6	-18.2	176.7	-57.7	-171.3	162.5	0	0	112.9	N201 P206	N201-E203 PolarHBondContact O-N 3.5Å; N201-E203 WeakPolarHBondContact OD1-CB 3.11Å; N201-E203 PolarHBondContact OD1-N 3.26Å; E203-P206 VanDerWaalsContact O-CD 3.27Å; E203-P206 WeakPolarHBondContact O-CD 3.48Å; E203-P206 VanDerWaalsContact O-CG 3.31Å; E203-P206 WeakPolarHBondContact O-CG 3.33Å
204	L	88.9	Confident	88.7	Confident	59 Å²	59	86.2 Å²	86.2	31%	0.309	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-75.7	-22.5	178.1	-64.4	175.4	0	0	0	113	V197 N201 T202 V207 V208	V197-L204 HydrophobicContact CG1-CD1 3.71Å; N201-L204 HydrophobicContact CB-CD1 3.96Å; N201-L204 HydrophobicContact CB-CG 4.16Å; N201-L204 WeakPolarHBondContact O-CB 3.36Å; N201-L204 PolarHBondContact O-N 2.99Å; N201-L204 VanDerWaalsContact O-N 3.17Å; T202-L204 PolarHBondContact O-N 3.04Å; L204-V207 WeakPolarHBondContact O-CB 3.23Å; L204-V207 PolarHBondContact O-N 3.22Å; L204-V208 WeakPolarHBondContact O-CG2 3.33Å; L204-V208 PolarHBondContact O-N 3.31Å
205	A	85.8	Confident	89	Confident	27 Å²	27	82.9 Å²	82.9	22%	0.223	43%	0.43	C	S	.	.	H	α-helix	trans	-52.4	-51.9	-179	0	0	0	0	0	113.7	I198 T202 V207 R209	I198-A205 HydrophobicContact CG2-CB 3.77Å; T202-A205 WeakPolarHBondContact O-CB 3.4Å; T202-A205 PolarHBondContact O-N 3.41Å; A205-V207 VanDerWaalsContact C-N 3.25Å; A205-V207 PolarHBondContact O-N 3.14Å; A205-R209 WeakPolarHBondContact O-CB 3.3Å; A205-R209 PolarHBondContact O-N 3.22Å
206	P	88.1	Confident	89.1	Confident	79 Å²	79	86.6 Å²	86.6	51%	0.513	43%	0.433	S	S	.	.	H	α-helix	trans	-65.7	-26.3	177	25.5	-36	0	0	0	113.4	E203 K210	E203-P206 VanDerWaalsContact O-CD 3.27Å; E203-P206 WeakPolarHBondContact O-CD 3.48Å; E203-P206 VanDerWaalsContact O-CG 3.31Å; E203-P206 WeakPolarHBondContact O-CG 3.33Å; P206-K210 WeakPolarHBondContact O-CG 3.47Å
207	V	86.4	Confident	89.3	Confident	88 Å²	88	78.3 Å²	78.3	53%	0.533	40%	0.398	S	S	.	.	H	α-helix	trans	-75.4	-49.2	178.5	-177.1	0	0	0	0	110.4	L204 A205 R209 K210	L204-V207 WeakPolarHBondContact O-CB 3.23Å; L204-V207 PolarHBondContact O-N 3.22Å; A205-V207 VanDerWaalsContact C-N 3.25Å; A205-V207 PolarHBondContact O-N 3.14Å; V207-R209 VanDerWaalsContact C-N 3.33Å; V207-R209 PolarHBondContact O-N 3.32Å; V207-K210 WeakPolarHBondContact O-CB 3.27Å; V207-K210 PolarHBondContact O-N 3.44Å; V207-K210 VanDerWaalsContact O-N 3.14Å
208	V	86.6	Confident	89.5	Confident	23 Å²	23	76.1 Å²	76.1	14%	0.139	39%	0.39	C	S	.	.	H	α-helix	trans	-61.2	-42.3	178.4	175.6	0	0	0	0	110.8	Y190 V191 F194 I198 L204 K210 G211	Y190-V208 HydrophobicContact CD1-CG1 4.17Å; Y190-V208 HydrophobicContact CE1-CG1 3.9Å; V191-V208 HydrophobicContact CG2-CG1 4.14Å; F194-V208 HydrophobicContact CB-CG1 4.02Å; F194-V208 HydrophobicContact CB-CG2 4.34Å; F194-V208 HydrophobicContact CD2-CG1 3.7Å; F194-V208 HydrophobicContact CE2-CG1 4.46Å; F194-V208 HydrophobicContact CG-CG1 3.96Å; F194-V208 HydrophobicContact CG-CG2 4.37Å; I198-V208 HydrophobicContact CD1-CB 4.38Å; I198-V208 HydrophobicContact CD1-CG1 4.45Å; I198-V208 HydrophobicContact CD1-CG2 4.44Å; L204-V208 WeakPolarHBondContact O-CG2 3.33Å; L204-V208 PolarHBondContact O-N 3.31Å; V208-K210 PolarHBondContact O-N 3.37Å; V208-K210 VanDerWaalsContact O-N 3.11Å; V208-G211 PolarHBondContact O-N 3.1Å
209	R	87.1	Confident	89.7	Confident	146 Å²	146	77.8 Å²	77.8	55%	0.551	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25	176.7	-90.8	-176.9	178.3	-154	-3.3	114.3	V187 V191 A205 V207 G211	V187-R209 HydrophobicContact CG1-CB 4.45Å; V187-R209 HydrophobicContact CG1-CG 4.23Å; V187-R209 WeakPolarHBondContact CG1-O 3.19Å; V191-R209 HydrophobicContact CG1-CG 4.45Å; V191-R209 HydrophobicContact CG2-CB 4.3Å; V191-R209 HydrophobicContact CG2-CG 3.46Å; V191-R209 VanDerWaalsContact CG2-CG 3.46Å; A205-R209 WeakPolarHBondContact O-CB 3.3Å; A205-R209 PolarHBondContact O-N 3.22Å; V207-R209 VanDerWaalsContact C-N 3.33Å; V207-R209 PolarHBondContact O-N 3.32Å; R209-G211 PolarHBondContact O-N 2.79Å
210	K	85.1	Confident	90	Very high	132 Å²	132	72.3 Å²	72.3	57%	0.574	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-21.6	175.5	-67.9	174.9	-179.3	176.9	0	112.3	P206 V207 V208 L212	P206-K210 WeakPolarHBondContact O-CG 3.47Å; V207-K210 WeakPolarHBondContact O-CB 3.27Å; V207-K210 PolarHBondContact O-N 3.44Å; V207-K210 VanDerWaalsContact O-N 3.14Å; V208-K210 PolarHBondContact O-N 3.37Å; V208-K210 VanDerWaalsContact O-N 3.11Å; K210-L212 HydrophobicContact CB-CD1 3.95Å; K210-L212 HydrophobicContact CB-CG 3.85Å; K210-L212 HydrophobicContact CD-CD1 4.08Å; K210-L212 PolarHBondContact O-N 3.16Å
211	G	84.6	Confident	90.2	Very high	2 Å²	2	63.7 Å²	63.7	2%	0.021	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	61	30.5	178.2	0	0	0	0	0	114	I179 V208 R209	I179-G211 PolarHBondContact N-O 2.63Å; I179-G211 VanDerWaalsContact N-O 3.07Å; V208-G211 PolarHBondContact O-N 3.1Å; R209-G211 PolarHBondContact O-N 2.79Å
212	L	89.1	Confident	90.5	Very high	89 Å²	89	65.9 Å²	65.9	47%	0.466	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.6	-178.4	-63.1	173.6	0	0	0	109.2	V176 D178 K210	V176-L212 HydrophobicContact CG1-CB 4.34Å; V176-L212 HydrophobicContact CG1-CD2 3.89Å; D178-L212 HydrophobicContact CB-CD2 3.75Å; K210-L212 HydrophobicContact CB-CD1 3.95Å; K210-L212 HydrophobicContact CB-CG 3.85Å; K210-L212 HydrophobicContact CD-CD1 4.08Å; K210-L212 PolarHBondContact O-N 3.16Å
213	E	90.6	Very high	90.9	Very high	58 Å²	58	60.8 Å²	60.8	27%	0.271	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.9	169.9	178	174.4	-140.4	0	0	110.4	V176 H177 I179 K219	V176-E213 CarbonylContact C-O 2.99Å; V176-E213 WeakPolarHBondContact CA-O 3.43Å; H177-E213 HydrophobicContact CB-CB 4.4Å; H177-E213 PolarHBondContact N-O 2.99Å; H177-E213 PolarHBondContact O-N 3.25Å; I179-E213 HydrophobicContact CD1-CB 3.97Å; I179-E213 HydrophobicContact CG1-CB 4.49Å; E213-K219 IonicContact OE1-NZ 3.67Å; E213-K219 PolarHBondContact OE1-NZ 3.01Å; E213-K219 IonicContact OE2-NZ 3.7Å; E213-K219 PolarHBondContact OE2-NZ 3.47Å
214	I	91.3	Very high	91.3	Very high	79 Å²	79	53.6 Å²	53.6	41%	0.405	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	111	170.2	-61.1	172.5	0	0	0	108.3	Y174 R216	Y174-I214 HydrophobicContact CD1-CD1 4.14Å; Y174-I214 HydrophobicContact CD1-CG2 3.75Å; Y174-I214 HydrophobicContact CE1-CD1 4.22Å; Y174-I214 HydrophobicContact CE1-CG2 4.29Å; I214-R216 HydrophobicContact CG2-CG 4.16Å; I214-R216 PolarHBondContact O-N 3.46Å
215	I	94.2	Very high	91.6	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.			trans	-78.7	94	172.2	-53.8	-179.9	0	0	0	107.6	Y93 L105 K110 V175 H177 K219 A220	Y93-I215 PolarHBondContact OH-O 3.37Å; L105-I215 HydrophobicContact CD1-CD1 4.36Å; L105-I215 HydrophobicContact CD1-CG2 4.22Å; L105-I215 HydrophobicContact CD2-CD1 4.4Å; L105-I215 HydrophobicContact CD2-CG2 4.45Å; K110-I215 HydrophobicContact CG-CD1 4.12Å; V175-I215 HydrophobicContact CB-CB 4.36Å; V175-I215 HydrophobicContact CG1-CB 4.44Å; V175-I215 PolarHBondContact O-N 3.11Å; H177-I215 HydrophobicContact CB-CD1 3.87Å; H177-I215 HydrophobicContact CB-CG1 4.08Å; I215-K219 HydrophobicContact CG2-CB 4.3Å; I215-K219 HydrophobicContact CG2-CG 4.4Å; I215-A220 HydrophobicContact CG2-CB 3.95Å
216	R	91.8	Very high	92.1	Very high	124 Å²	124	57.8 Å²	57.8	47%	0.468	28%	0.282	S	S	.	.			trans	-68.1	156.9	171.4	-70.6	-173.6	177	150.8	-0.9	111.2	I214 G218 K219 A220	I214-R216 HydrophobicContact CG2-CG 4.16Å; I214-R216 PolarHBondContact O-N 3.46Å; R216-G218 PolarHBondContact O-N 3.14Å; R216-G218 VanDerWaalsContact O-N 3.15Å; R216-K219 PolarHBondContact O-N 3.41Å; R216-A220 PolarHBondContact O-N 3.43Å
217	P	93.9	Very high	92.5	Very high	4 Å²	4	54.4 Å²	54.4	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-53.9	-37.7	-178.3	-23.4	29.2	0	0	0	113.8	P91 Y93 K219 A220 M221 I251 H310	P91-P217 HydrophobicContact CB-CB 4.3Å; P91-P217 HydrophobicContact CG-CB 4.43Å; P91-P217 VanDerWaalsContact O-CB 3.23Å; P91-P217 WeakPolarHBondContact O-CB 3.42Å; P91-P217 WeakPolarHBondContact O-CG 3.36Å; Y93-P217 HydrophobicContact CD1-CB 4.24Å; Y93-P217 HydrophobicContact CD1-CG 4.34Å; Y93-P217 HydrophobicContact CD2-CG 3.76Å; Y93-P217 HydrophobicContact CE1-CB 4.17Å; Y93-P217 HydrophobicContact CE1-CG 4.37Å; Y93-P217 HydrophobicContact CE2-CB 4.43Å; Y93-P217 HydrophobicContact CE2-CG 3.79Å; Y93-P217 HydrophobicContact CG-CB 4.41Å; Y93-P217 HydrophobicContact CG-CG 4.05Å; P217-K219 PolarHBondContact O-N 2.88Å; P217-A220 PolarHBondContact O-N 3.03Å; P217-M221 VanDerWaalsContact O-CB 3.28Å; P217-M221 WeakPolarHBondContact O-CB 3.34Å; P217-M221 PolarHBondContact O-N 2.78Å; P217-I251 HydrophobicContact CB-CG2 4.12Å; P217-H310 WeakPolarHBondContact CG-NE2 3.39Å
218	G	93.5	Very high	92.8	Very high	27 Å²	27	51.5 Å²	51.5	28%	0.278	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-43.7	176.3	0	0	0	0	0	113.1	R216 M221 Q222	R216-G218 PolarHBondContact O-N 3.14Å; R216-G218 VanDerWaalsContact O-N 3.15Å; G218-M221 PolarHBondContact O-N 3.43Å; G218-Q222 WeakPolarHBondContact O-CG 3.33Å; G218-Q222 PolarHBondContact O-N 2.97Å; G218-Q222 VanDerWaalsContact O-N 3.08Å
219	K	95	Very high	93.1	Very high	60 Å²	60	56 Å²	56	26%	0.261	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-45.2	174.4	-173.7	175	-174.5	179.8	0	111.1	E213 I215 R216 P217 M221 Q222 L223	E213-K219 IonicContact OE1-NZ 3.67Å; E213-K219 PolarHBondContact OE1-NZ 3.01Å; E213-K219 IonicContact OE2-NZ 3.7Å; E213-K219 PolarHBondContact OE2-NZ 3.47Å; I215-K219 HydrophobicContact CG2-CB 4.3Å; I215-K219 HydrophobicContact CG2-CG 4.4Å; R216-K219 PolarHBondContact O-N 3.41Å; P217-K219 PolarHBondContact O-N 2.88Å; K219-M221 VanDerWaalsContact C-N 3.29Å; K219-M221 PolarHBondContact O-N 2.95Å; K219-Q222 PolarHBondContact O-N 2.67Å; K219-L223 HydrophobicContact CG-CD1 4.28Å; K219-L223 HydrophobicContact CG-CG 4.46Å; K219-L223 WeakPolarHBondContact O-CG 3.18Å; K219-L223 PolarHBondContact O-N 2.82Å
220	A	96.4	Very high	93.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.9	-41.9	177.1	0	0	0	0	0	111.9	Y93 L105 I215 R216 P217 L223 F224 I251	Y93-A220 HydrophobicContact CE1-CB 3.73Å; Y93-A220 WeakPolarHBondContact OH-CB 3.25Å; L105-A220 HydrophobicContact CD1-CB 4.45Å; L105-A220 HydrophobicContact CD2-CB 4.48Å; I215-A220 HydrophobicContact CG2-CB 3.95Å; R216-A220 PolarHBondContact O-N 3.43Å; P217-A220 PolarHBondContact O-N 3.03Å; A220-L223 PolarHBondContact O-N 3.27Å; A220-F224 WeakPolarHBondContact O-CB 3.39Å; A220-F224 WeakPolarHBondContact O-CD1 3.42Å; A220-F224 WeakPolarHBondContact O-CG 3.31Å; A220-F224 PolarHBondContact O-N 2.93Å; A220-I251 HydrophobicContact CB-CD1 4.22Å
221	M	96.2	Very high	93.6	Very high	11 Å²	11	47.2 Å²	47.2	5%	0.054	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-43.3	176.7	-170.8	172.4	176.2	0	0	112.4	E24 P91 P217 G218 K219 F224 S225 R248 I251 Q253	E24-M221 WeakPolarHBondContact OE1-CE 3.42Å; P91-M221 HydrophobicContact CB-SD 3.8Å; P91-M221 HydrophobicContact CG-SD 4.18Å; P217-M221 VanDerWaalsContact O-CB 3.28Å; P217-M221 WeakPolarHBondContact O-CB 3.34Å; P217-M221 PolarHBondContact O-N 2.78Å; G218-M221 PolarHBondContact O-N 3.43Å; K219-M221 VanDerWaalsContact C-N 3.29Å; K219-M221 PolarHBondContact O-N 2.95Å; M221-F224 PolarHBondContact O-N 2.89Å; M221-S225 WeakPolarHBondContact O-CB 3.36Å; M221-S225 PolarHBondContact O-N 2.82Å; M221-S225 PolarHBondContact O-OG 3.48Å; M221-R248 HydrophobicContact CE-CG 4.37Å; M221-R248 HydrophobicContact CG-CG 4.09Å; M221-I251 HydrophobicContact CB-CB 4.27Å; M221-I251 HydrophobicContact CB-CG1 4.11Å; M221-I251 HydrophobicContact CB-CG2 4.13Å; M221-I251 HydrophobicContact CG-CB 4.35Å; M221-I251 HydrophobicContact CG-CG2 4.41Å; M221-I251 HydrophobicContact SD-CB 4.48Å; M221-I251 HydrophobicContact SD-CG2 4.1Å; M221-Q253 HydrophobicContact CE-CB 4.32Å
222	Q	97	Very high	94	Very high	118 Å²	118	47.1 Å²	47.1	55%	0.551	23%	0.228	S	C	*	.	H	α-helix	trans	-65.8	-39.3	174.3	-71.1	177	3.1	0	0	112.5	G218 K219 R226	G218-Q222 WeakPolarHBondContact O-CG 3.33Å; G218-Q222 PolarHBondContact O-N 2.97Å; G218-Q222 VanDerWaalsContact O-N 3.08Å; K219-Q222 PolarHBondContact O-N 2.67Å; Q222-R226 WeakPolarHBondContact O-CG 3.33Å; Q222-R226 PolarHBondContact O-N 3.44Å; Q222-R226 PolarHBondContact O-NE 3.29Å; Q222-R226 VanDerWaalsContact O-NE 3.16Å
223	L	97.9	Very high	94.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-48	175.5	-72.7	173	0	0	0	110.5	L105 I108 K110 S113 K219 A220 S225 R226 I227	L105-L223 HydrophobicContact CD2-CD1 3.98Å; I108-L223 HydrophobicContact CD1-CB 4.34Å; K110-L223 HydrophobicContact CG-CD1 4.28Å; K110-L223 VanDerWaalsContact O-CD2 3.32Å; K110-L223 WeakPolarHBondContact O-CD2 3.46Å; S113-L223 VanDerWaalsContact CB-O 3.29Å; S113-L223 WeakPolarHBondContact CB-O 3.26Å; S113-L223 WeakPolarHBondContact OG-CA 3.5Å; S113-L223 PolarHBondContact OG-O 2.89Å; K219-L223 HydrophobicContact CG-CD1 4.28Å; K219-L223 HydrophobicContact CG-CG 4.46Å; K219-L223 WeakPolarHBondContact O-CG 3.18Å; K219-L223 PolarHBondContact O-N 2.82Å; A220-L223 PolarHBondContact O-N 3.27Å; L223-S225 VanDerWaalsContact C-N 3.34Å; L223-S225 PolarHBondContact O-N 3.34Å; L223-R226 PolarHBondContact O-N 3.38Å; L223-R226 VanDerWaalsContact O-N 3.13Å; L223-I227 PolarHBondContact O-N 2.87Å
224	F	97.2	Very high	94.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-42.5	178.7	-70.4	-6.4	0	0	0	111.9	I101 I104 L105 I108 A220 M221 R226 I227 H246 P247 R248 I251	I101-F224 HydrophobicContact CB-CZ 4.45Å; I101-F224 HydrophobicContact CG1-CE2 4.28Å; I101-F224 HydrophobicContact CG2-CE2 4.15Å; I101-F224 HydrophobicContact CG2-CZ 3.93Å; I104-F224 HydrophobicContact CB-CE1 4.1Å; I104-F224 HydrophobicContact CB-CZ 4.18Å; I104-F224 HydrophobicContact CG2-CD1 4.08Å; I104-F224 HydrophobicContact CG2-CE1 3.5Å; I104-F224 HydrophobicContact CG2-CZ 4.03Å; L105-F224 HydrophobicContact CD2-CE1 3.69Å; L105-F224 HydrophobicContact CD2-CZ 4.19Å; L105-F224 HydrophobicContact CG-CE1 3.89Å; L105-F224 HydrophobicContact CG-CZ 3.99Å; I108-F224 HydrophobicContact CD1-CD1 4.01Å; I108-F224 HydrophobicContact CD1-CE1 4.13Å; A220-F224 WeakPolarHBondContact O-CB 3.39Å; A220-F224 WeakPolarHBondContact O-CD1 3.42Å; A220-F224 WeakPolarHBondContact O-CG 3.31Å; A220-F224 PolarHBondContact O-N 2.93Å; M221-F224 PolarHBondContact O-N 2.89Å; F224-R226 PolarHBondContact O-N 3.1Å; F224-I227 HydrophobicContact CB-CD1 4.44Å; F224-I227 HydrophobicContact CD1-CD1 4.04Å; F224-I227 WeakPolarHBondContact O-CB 3.44Å; F224-I227 WeakPolarHBondContact O-CG1 3.48Å; F224-I227 PolarHBondContact O-N 3.16Å; F224-H246 PolarHBondContact O-CE1 2.99Å; F224-H246 PolarHBondContact O-NE2 3.38Å; F224-P247 HydrophobicContact CB-CB 3.92Å; F224-P247 HydrophobicContact CD1-CB 4.2Å; F224-P247 HydrophobicContact CD2-CB 3.95Å; F224-P247 WeakPolarHBondContact CD2-O 3.37Å; F224-P247 HydrophobicContact CG-CB 3.76Å; F224-R248 HydrophobicContact CB-CB 4.5Å; F224-I251 HydrophobicContact CD2-CD1 4.37Å; F224-I251 HydrophobicContact CD2-CG1 4.04Å; F224-I251 HydrophobicContact CE2-CD1 4.06Å; F224-I251 HydrophobicContact CE2-CG1 4.23Å
225	S	95.5	Very high	94.5	Very high	47 Å²	47	37.8 Å²	37.8	33%	0.329	18%	0.182	S	C	.	.	H	α-helix	trans	-64.3	-20.1	177.3	-54.5	0	0	0	0	113.8	M221 L223 R248	M221-S225 WeakPolarHBondContact O-CB 3.36Å; M221-S225 PolarHBondContact O-N 2.82Å; M221-S225 PolarHBondContact O-OG 3.48Å; L223-S225 VanDerWaalsContact C-N 3.34Å; L223-S225 PolarHBondContact O-N 3.34Å; S225-R248 WeakPolarHBondContact OG-CD 3.49Å; S225-R248 PolarHBondContact OG-NH1 3.3Å
226	R	96.9	Very high	94.4	Very high	127 Å²	127	39.7 Å²	39.7	48%	0.479	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-0.2	178.6	-75.2	-176.8	-78.9	165.7	-11.8	113.6	T111 S113 Q222 L223 F224 P228	T111-R226 PolarHBondContact O-NH1 3.06Å; S113-R226 WeakPolarHBondContact CB-O 3.45Å; S113-R226 WeakPolarHBondContact OG-CB 3.49Å; Q222-R226 WeakPolarHBondContact O-CG 3.33Å; Q222-R226 PolarHBondContact O-N 3.44Å; Q222-R226 PolarHBondContact O-NE 3.29Å; Q222-R226 VanDerWaalsContact O-NE 3.16Å; L223-R226 PolarHBondContact O-N 3.38Å; L223-R226 VanDerWaalsContact O-N 3.13Å; F224-R226 PolarHBondContact O-N 3.1Å; R226-P228 WeakPolarHBondContact O-CD 3.34Å
227	I	96.1	Very high	94.2	Very high	7 Å²	7	34.8 Å²	34.8	4%	0.036	18%	0.175	C	C	.	.	S	Bend	trans	-66.1	123.8	175.2	-62.1	169	0	0	0	107.6	I104 I108 L223 F224 D231 L232 L235 P247	I104-I227 HydrophobicContact CG2-CD1 4.33Å; I108-I227 HydrophobicContact CD1-CD1 4Å; I108-I227 HydrophobicContact CD1-CG1 4.19Å; I108-I227 HydrophobicContact CG2-CD1 4.2Å; I108-I227 HydrophobicContact CG2-CG1 4.42Å; L223-I227 PolarHBondContact O-N 2.87Å; F224-I227 HydrophobicContact CB-CD1 4.44Å; F224-I227 HydrophobicContact CD1-CD1 4.04Å; F224-I227 WeakPolarHBondContact O-CB 3.44Å; F224-I227 WeakPolarHBondContact O-CG1 3.48Å; F224-I227 PolarHBondContact O-N 3.16Å; I227-D231 HydrophobicContact CG2-CB 4.11Å; I227-L232 HydrophobicContact CB-CD2 4.49Å; I227-L232 HydrophobicContact CG2-CD2 3.95Å; I227-L235 HydrophobicContact CD1-CD1 3.97Å; I227-L235 HydrophobicContact CG2-CD1 4.41Å; I227-P247 HydrophobicContact CD1-CB 4.1Å; I227-P247 HydrophobicContact CD1-CG 3.87Å
228	P	93.7	Very high	93.2	Very high	27 Å²	27	37.6 Å²	37.6	18%	0.175	19%	0.193	C	C	.	.			trans	-60.3	141.7	176.7	-23	34.3	0	0	0	111.5	R114 R226 E230 D231	R114-P228 HydrophobicContact CG-CG 4.35Å; R226-P228 WeakPolarHBondContact O-CD 3.34Å; P228-E230 HydrophobicContact CB-CG 3.76Å; P228-E230 PolarHBondContact O-N 3.14Å; P228-D231 WeakPolarHBondContact O-CB 3.4Å; P228-D231 PolarHBondContact O-N 2.89Å
229	E	91.3	Very high	91.8	Very high	117 Å²	117	40.9 Å²	40.9	55%	0.547	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-57.9	-35.1	-179.3	-66.8	-177.8	171.9	0	0	112.5	D231 L232 P233	E229-D231 PolarHBondContact O-N 3.16Å; E229-L232 HydrophobicContact CB-CD1 4.34Å; E229-L232 HydrophobicContact CG-CD1 4.4Å; E229-L232 WeakPolarHBondContact O-CB 3.49Å; E229-L232 PolarHBondContact O-N 3.32Å; E229-L232 VanDerWaalsContact O-N 3.13Å; E229-P233 WeakPolarHBondContact O-CD 3.49Å
230	E	91	Very high	90.4	Very high	95 Å²	95	39.9 Å²	39.9	44%	0.444	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-62.9	-21	175	55.2	172.8	161.2	0	0	114.3	R114 R122 L126 P228	R114-E230 IonicContact CZ-OE1 3.88Å; R114-E230 VanDerWaalsContact NH1-CD 3.26Å; R114-E230 IonicContact NH1-OE1 3.88Å; R114-E230 PolarHBondContact NH1-OE1 3.27Å; R114-E230 IonicContact NH1-OE2 3.41Å; R114-E230 IonicContact NH2-OE1 2.69Å; R114-E230 PolarHBondContact NH2-OE1 3.46Å; R122-E230 IonicContact CZ-OE2 2.75Å; R122-E230 IonicContact NH1-OE2 2.73Å; R122-E230 VanDerWaalsContact NH2-CG 3.34Å; R122-E230 IonicContact NH2-OE1 2.78Å; R122-E230 IonicContact NH2-OE2 3.96Å; R122-E230 PolarHBondContact NH2-OE2 3.2Å; L126-E230 VanDerWaalsContact CD2-O 3.23Å; L126-E230 WeakPolarHBondContact CD2-O 3.38Å; P228-E230 HydrophobicContact CB-CG 3.76Å; P228-E230 PolarHBondContact O-N 3.14Å
231	D	93.5	Very high	88.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-91.7	-14.2	177.3	-76.8	4	0	0	0	112.4	R114 V115 R122 I227 P228 E229 L234	R114-D231 WeakPolarHBondContact CA-OD2 3.46Å; R114-D231 WeakPolarHBondContact CD-OD2 3.44Å; R114-D231 IonicContact NH1-OD1 3.37Å; V115-D231 HydrophobicContact CG2-CB 3.97Å; V115-D231 PolarHBondContact N-OD2 3.41Å; R122-D231 IonicContact CZ-OD1 3.89Å; R122-D231 IonicContact NE-OD1 3.72Å; R122-D231 PolarHBondContact NE-OD1 3.3Å; R122-D231 IonicContact NH2-OD1 3.72Å; R122-D231 PolarHBondContact NH2-OD1 3.02Å; I227-D231 HydrophobicContact CG2-CB 4.11Å; P228-D231 WeakPolarHBondContact O-CB 3.4Å; P228-D231 PolarHBondContact O-N 2.89Å; E229-D231 PolarHBondContact O-N 3.16Å; D231-L234 VanDerWaalsContact O-CB 3.31Å; D231-L234 WeakPolarHBondContact O-CB 3.37Å; D231-L234 PolarHBondContact O-N 3.44Å
232	L	93.1	Very high	86.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-60.1	-38.8	-177.9	-62.1	174.8	0	0	0	113.8	I227 E229 L234 L235 L236 M237 F239 P247	I227-L232 HydrophobicContact CB-CD2 4.49Å; I227-L232 HydrophobicContact CG2-CD2 3.95Å; E229-L232 HydrophobicContact CB-CD1 4.34Å; E229-L232 HydrophobicContact CG-CD1 4.4Å; E229-L232 WeakPolarHBondContact O-CB 3.49Å; E229-L232 PolarHBondContact O-N 3.32Å; E229-L232 VanDerWaalsContact O-N 3.13Å; L232-L234 PolarHBondContact O-N 3.32Å; L232-L235 WeakPolarHBondContact O-CA 3.35Å; L232-L235 WeakPolarHBondContact O-CB 3.47Å; L232-L235 PolarHBondContact O-N 3.37Å; L232-L236 PolarHBondContact O-N 3.5Å; L232-M237 CarbonylContact C-O 3.58Å; L232-M237 VanDerWaalsContact CB-O 3.31Å; L232-M237 WeakPolarHBondContact CB-O 3.26Å; L232-M237 PolarHBondContact O-N 2.87Å; L232-F239 HydrophobicContact CD1-CB 4.18Å; L232-F239 HydrophobicContact CD1-CD2 4.14Å; L232-P247 HydrophobicContact CD2-CG 4.14Å
233	P	91.8	Very high	85.3	Confident	21 Å²	21	52 Å²	52	14%	0.136	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.3	-33	172.9	-26.5	36.2	0	0	0	113.2	L126 C129 E229 L235 L236	L126-P233 HydrophobicContact CD2-CB 4.26Å; C129-P233 HydrophobicContact CB-CB 4.22Å; C129-P233 WeakPolarHBondContact CB-O 3.31Å; E229-P233 WeakPolarHBondContact O-CD 3.49Å; P233-L235 PolarHBondContact O-N 3.26Å; P233-L236 WeakPolarHBondContact O-CA 3.45Å; P233-L236 PolarHBondContact O-N 2.81Å
234	L	94.6	Very high	84.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-68.6	-21.3	177.6	-60.6	167	0	0	0	112.8	V115 R122 F125 L126 I146 D231 L232 L236	V115-L234 HydrophobicContact CB-CD1 4.15Å; V115-L234 HydrophobicContact CG1-CB 4.45Å; V115-L234 HydrophobicContact CG1-CD1 4.13Å; V115-L234 HydrophobicContact CG2-CB 4.27Å; V115-L234 HydrophobicContact CG2-CD1 4.37Å; R122-L234 HydrophobicContact CG-CD1 3.69Å; F125-L234 HydrophobicContact CB-CD2 3.55Å; L126-L234 HydrophobicContact CD2-CD1 4.06Å; L126-L234 HydrophobicContact CD2-CD2 3.93Å; L126-L234 HydrophobicContact CD2-CG 3.66Å; L126-L234 HydrophobicContact CG-CD1 4.27Å; L126-L234 HydrophobicContact CG-CD2 3.92Å; L126-L234 HydrophobicContact CG-CG 4.1Å; I146-L234 HydrophobicContact CD1-CB 4.46Å; I146-L234 HydrophobicContact CD1-CD2 4.25Å; I146-L234 WeakPolarHBondContact CD1-O 3.4Å; D231-L234 VanDerWaalsContact O-CB 3.31Å; D231-L234 WeakPolarHBondContact O-CB 3.37Å; D231-L234 PolarHBondContact O-N 3.44Å; L232-L234 PolarHBondContact O-N 3.32Å; L234-L236 VanDerWaalsContact C-N 3.26Å
235	L	94.2	Very high	83.4	Confident	8 Å²	8	56.2 Å²	56.2	4%	0.042	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-86.6	-0.4	170.9	-56.3	-177.7	0	0	0	112.3	I104 T107 V115 I227 L232 P233 M237 P247	I104-L235 HydrophobicContact CG2-CD1 4.01Å; T107-L235 HydrophobicContact CG2-CD2 3.84Å; V115-L235 HydrophobicContact CG2-CD2 4.03Å; V115-L235 HydrophobicContact CG2-CG 4.35Å; I227-L235 HydrophobicContact CD1-CD1 3.97Å; I227-L235 HydrophobicContact CG2-CD1 4.41Å; L232-L235 WeakPolarHBondContact O-CA 3.35Å; L232-L235 WeakPolarHBondContact O-CB 3.47Å; L232-L235 PolarHBondContact O-N 3.37Å; P233-L235 PolarHBondContact O-N 3.26Å; L235-M237 HydrophobicContact CB-CG 4.27Å; L235-M237 HydrophobicContact CB-SD 4.45Å; L235-M237 PolarHBondContact O-N 3.22Å; L235-P247 HydrophobicContact CD1-CG 3.81Å
236	L	91.5	Very high	83.2	Confident	40 Å²	40	55.5 Å²	55.5	21%	0.209	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	37.7	-168.4	-59.4	-175.6	0	0	0	112.9	C129 K139 L142 R143 L232 P233 L234 P238	C129-L236 HydrophobicContact CB-CD2 3.79Å; K139-L236 VanDerWaalsContact C-CD1 3.49Å; K139-L236 HydrophobicContact CB-CD1 3.8Å; K139-L236 HydrophobicContact CG-CD1 4.24Å; K139-L236 WeakPolarHBondContact O-CD1 3.49Å; L142-L236 HydrophobicContact CB-CD1 4.42Å; R143-L236 HydrophobicContact CB-CD1 3.77Å; R143-L236 HydrophobicContact CB-CG 4.47Å; L232-L236 PolarHBondContact O-N 3.5Å; P233-L236 WeakPolarHBondContact O-CA 3.45Å; P233-L236 PolarHBondContact O-N 2.81Å; L234-L236 VanDerWaalsContact C-N 3.26Å; L236-P238 WeakPolarHBondContact O-CD 3.29Å
237	M	88.8	Confident	83.1	Confident	22 Å²	22	49.4 Å²	49.4	11%	0.108	25%	0.252	C	S	.	.			trans	-117	76.9	173.9	-62.6	-177.7	79	0	0	106.7	L21 I104 L232 L235 T245 H246 P247	L21-M237 HydrophobicContact CD1-CE 3.79Å; I104-M237 HydrophobicContact CD1-SD 4.2Å; L232-M237 CarbonylContact C-O 3.58Å; L232-M237 VanDerWaalsContact CB-O 3.31Å; L232-M237 WeakPolarHBondContact CB-O 3.26Å; L232-M237 PolarHBondContact O-N 2.87Å; L235-M237 HydrophobicContact CB-CG 4.27Å; L235-M237 HydrophobicContact CB-SD 4.45Å; L235-M237 PolarHBondContact O-N 3.22Å; M237-T245 HydrophobicContact CE-CG2 3.62Å; M237-H246 VanDerWaalsContact CE-C 3.49Å; M237-P247 HydrophobicContact CE-CG 4.23Å; M237-P247 HydrophobicContact SD-CB 4.36Å; M237-P247 HydrophobicContact SD-CG 3.64Å
238	P	71.3	Confident	83	Confident	62 Å²	62	53 Å²	53	40%	0.403	26%	0.264	S	S	.	.			trans	-63	143.9	-171.8	25.6	-33.2	0	0	0	111.3	L236	L236-P238 WeakPolarHBondContact O-CD 3.29Å
239	F	65.2	Low	83	Confident	96 Å²	96	53.2 Å²	53.2	42%	0.421	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-105.8	85.6	169.8	-169.5	-88.6	0	0	0	106.5	L232 T244	L232-F239 HydrophobicContact CD1-CB 4.18Å; L232-F239 HydrophobicContact CD1-CD2 4.14Å; F239-T244 HydrophobicContact CD2-CG2 3.5Å; F239-T244 HydrophobicContact CE2-CG2 3.46Å; F239-T244 VanDerWaalsContact CE2-CG2 3.46Å
240	D	66.4	Low	83.2	Confident	39 Å²	39	48 Å²	48	21%	0.209	24%	0.24	C	C	.	.			trans	-101.2	164.5	172.6	107.9	-28.6	0	0	0	109.8	R242 W243	D240-R242 PolarHBondContact O-N 3.03Å; D240-R242 VanDerWaalsContact OD1-CA 3.27Å; D240-R242 WeakPolarHBondContact OD1-CA 3.49Å; D240-R242 VanDerWaalsContact OD1-CB 3.27Å; D240-R242 WeakPolarHBondContact OD1-CB 3.41Å; D240-R242 PolarHBondContact OD1-N 3.48Å; D240-R242 IonicContact OD2-CZ 3.91Å; D240-R242 IonicContact OD2-NE 2.78Å; D240-R242 PolarHBondContact OD2-NE 3.2Å; D240-R242 IonicContact OD2-NH2 3.16Å; D240-R242 PolarHBondContact OD2-NH2 2.87Å; D240-W243 PolarHBondContact O-N 3.5Å; D240-W243 PolarHBondContact OD1-N 3.28Å
241	S	57.9	Low	83.4	Confident	128 Å²	128	43.7 Å²	43.7	90%	0.895	22%	0.22	S	C	*	.	S	Bend	trans	-66.4	-5.1	-177.6	62	0	0	0	0	114.4
242	R	59.8	Low	83.5	Confident	176 Å²	176	44.4 Å²	44.4	66%	0.664	22%	0.224	S	C	*	.	S	Bend	trans	-109.7	-28.2	-175.1	-63	178.4	-75.4	-165.2	-9.8	112.2	D240	D240-R242 PolarHBondContact O-N 3.03Å; D240-R242 VanDerWaalsContact OD1-CA 3.27Å; D240-R242 WeakPolarHBondContact OD1-CA 3.49Å; D240-R242 VanDerWaalsContact OD1-CB 3.27Å; D240-R242 WeakPolarHBondContact OD1-CB 3.41Å; D240-R242 PolarHBondContact OD1-N 3.48Å; D240-R242 IonicContact OD2-CZ 3.91Å; D240-R242 IonicContact OD2-NE 2.78Å; D240-R242 PolarHBondContact OD2-NE 3.2Å; D240-R242 IonicContact OD2-NH2 3.16Å; D240-R242 PolarHBondContact OD2-NH2 2.87Å
243	W	64.5	Low	83.6	Confident	79 Å²	79	47.2 Å²	47.2	30%	0.299	24%	0.238	S	C	.	.			trans	-157.1	135.4	174.2	50.2	83.1	0	0	0	113.1	K18 D240	K18-W243 HydrophobicContact CD-CH2 4.4Å; K18-W243 HydrophobicContact CD-CZ3 4.29Å; D240-W243 PolarHBondContact O-N 3.5Å; D240-W243 PolarHBondContact OD1-N 3.28Å
244	T	71.7	Confident	83.8	Confident	67 Å²	67	48 Å²	48	41%	0.411	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-106	113.2	178.9	-57.3	0	0	0	0	109.8	F239	F239-T244 HydrophobicContact CD2-CG2 3.5Å; F239-T244 HydrophobicContact CE2-CG2 3.46Å; F239-T244 VanDerWaalsContact CE2-CG2 3.46Å
245	T	82.7	Confident	83.9	Confident	23 Å²	23	48 Å²	48	14%	0.141	24%	0.238	C	C	.	.			trans	-109.3	118.5	170.6	-58.2	0	0	0	0	108.8	L21 M237	L21-T245 HydrophobicContact CB-CG2 4.27Å; L21-T245 HydrophobicContact CD1-CG2 3.87Å; L21-T245 HydrophobicContact CG-CG2 4.03Å; M237-T245 HydrophobicContact CE-CG2 3.62Å
246	H	91.7	Very high	84	Confident	31 Å²	31	49.9 Å²	49.9	14%	0.144	25%	0.251	C	S	.	.			trans	-123.8	139.5	-172.4	-169.8	-91.3	0	0	0	111.8	F224 M237 R248 N249	F224-H246 PolarHBondContact O-CE1 2.99Å; F224-H246 PolarHBondContact O-NE2 3.38Å; M237-H246 VanDerWaalsContact CE-C 3.49Å; H246-R248 WeakPolarHBondContact ND1-CB 3.39Å; H246-R248 PolarHBondContact ND1-N 3.24Å; H246-R248 PolarHBondContact O-N 3.06Å; H246-R248 VanDerWaalsContact O-N 3.1Å; H246-N249 WeakPolarHBondContact O-CB 3.32Å; H246-N249 PolarHBondContact O-N 3.42Å
247	P	94.7	Very high	84.3	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-53.2	-31.1	179	-28.7	33.9	0	0	0	114.7	I104 F224 I227 L232 L235 M237 N249 L250	I104-P247 HydrophobicContact CD1-CB 4.3Å; F224-P247 HydrophobicContact CB-CB 3.92Å; F224-P247 HydrophobicContact CD1-CB 4.2Å; F224-P247 HydrophobicContact CD2-CB 3.95Å; F224-P247 WeakPolarHBondContact CD2-O 3.37Å; F224-P247 HydrophobicContact CG-CB 3.76Å; I227-P247 HydrophobicContact CD1-CB 4.1Å; I227-P247 HydrophobicContact CD1-CG 3.87Å; L232-P247 HydrophobicContact CD2-CG 4.14Å; L235-P247 HydrophobicContact CD1-CG 3.81Å; M237-P247 HydrophobicContact CE-CG 4.23Å; M237-P247 HydrophobicContact SD-CB 4.36Å; M237-P247 HydrophobicContact SD-CG 3.64Å; P247-N249 PolarHBondContact O-N 2.87Å; P247-L250 VanDerWaalsContact O-CB 3.26Å; P247-L250 WeakPolarHBondContact O-CB 3.41Å; P247-L250 WeakPolarHBondContact O-CG 3.49Å; P247-L250 PolarHBondContact O-N 3.48Å
248	R	94.6	Very high	84.6	Confident	81 Å²	81	47.2 Å²	47.2	31%	0.306	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-51.8	-38.7	174.4	-178.1	-171.2	170.3	104.5	-5.3	112	E24 M221 F224 S225 H246 L250 I251	E24-R248 IonicContact OE1-NH2 2.72Å; E24-R248 IonicContact OE2-NH2 3.64Å; M221-R248 HydrophobicContact CE-CG 4.37Å; M221-R248 HydrophobicContact CG-CG 4.09Å; F224-R248 HydrophobicContact CB-CB 4.5Å; S225-R248 WeakPolarHBondContact OG-CD 3.49Å; S225-R248 PolarHBondContact OG-NH1 3.3Å; H246-R248 WeakPolarHBondContact ND1-CB 3.39Å; H246-R248 PolarHBondContact ND1-N 3.24Å; H246-R248 PolarHBondContact O-N 3.06Å; H246-R248 VanDerWaalsContact O-N 3.1Å; R248-L250 PolarHBondContact O-N 3.38Å; R248-L250 VanDerWaalsContact O-N 3.09Å; R248-I251 PolarHBondContact O-N 2.82Å
249	N	93.6	Very high	85.8	Confident	32 Å²	32	44.5 Å²	44.5	17%	0.171	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-71.9	-2.1	-176.4	-57	-12.1	0	0	0	113	L21 H246 P247 I251	L21-N249 HydrophobicContact CB-CB 3.91Å; L21-N249 HydrophobicContact CD1-CB 4.31Å; H246-N249 WeakPolarHBondContact O-CB 3.32Å; H246-N249 PolarHBondContact O-N 3.42Å; P247-N249 PolarHBondContact O-N 2.87Å; N249-I251 VanDerWaalsContact C-N 3.33Å
250	L	95.1	Very high	87.1	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.037	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-80.8	-18.1	169.3	-59.4	170.9	0	0	0	112.3	L21 H94 Y97 I101 I104 P247 R248	L21-L250 HydrophobicContact CD1-CD2 3.43Å; L21-L250 VanDerWaalsContact CD1-CD2 3.43Å; L21-L250 HydrophobicContact CD1-CG 3.91Å; L21-L250 HydrophobicContact CD2-CD2 4.04Å; L21-L250 HydrophobicContact CG-CD2 4.39Å; H94-L250 WeakPolarHBondContact CB-O 3.4Å; H94-L250 PolarHBondContact N-O 2.97Å; Y97-L250 HydrophobicContact CD1-CD2 4.26Å; Y97-L250 HydrophobicContact CD2-CD2 3.71Å; Y97-L250 HydrophobicContact CE2-CD2 4.37Å; Y97-L250 HydrophobicContact CG-CD2 3.68Å; I101-L250 HydrophobicContact CD1-CB 4.15Å; I101-L250 HydrophobicContact CG1-CB 3.81Å; I101-L250 HydrophobicContact CG1-CD1 4.15Å; I104-L250 HydrophobicContact CD1-CD1 3.47Å; I104-L250 VanDerWaalsContact CD1-CD1 3.47Å; P247-L250 VanDerWaalsContact O-CB 3.26Å; P247-L250 WeakPolarHBondContact O-CB 3.41Å; P247-L250 WeakPolarHBondContact O-CG 3.49Å; P247-L250 PolarHBondContact O-N 3.48Å; R248-L250 PolarHBondContact O-N 3.38Å; R248-L250 VanDerWaalsContact O-N 3.09Å
251	I	95.7	Very high	88.2	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.4	175.7	-48.8	-59.1	0	0	0	107.8	P91 I92 Y93 I101 P217 A220 M221 F224 R248 N249	P91-I251 HydrophobicContact CB-CG2 3.64Å; I92-I251 WeakPolarHBondContact O-CG2 3.42Å; Y93-I251 HydrophobicContact CD1-CD1 3.39Å; Y93-I251 HydrophobicContact CE1-CD1 3.5Å; Y93-I251 VanDerWaalsContact CE1-CD1 3.5Å; I101-I251 HydrophobicContact CD1-CD1 4.17Å; I101-I251 HydrophobicContact CG1-CD1 4.44Å; P217-I251 HydrophobicContact CB-CG2 4.12Å; A220-I251 HydrophobicContact CB-CD1 4.22Å; M221-I251 HydrophobicContact CB-CB 4.27Å; M221-I251 HydrophobicContact CB-CG1 4.11Å; M221-I251 HydrophobicContact CB-CG2 4.13Å; M221-I251 HydrophobicContact CG-CB 4.35Å; M221-I251 HydrophobicContact CG-CG2 4.41Å; M221-I251 HydrophobicContact SD-CB 4.48Å; M221-I251 HydrophobicContact SD-CG2 4.1Å; F224-I251 HydrophobicContact CD2-CD1 4.37Å; F224-I251 HydrophobicContact CD2-CG1 4.04Å; F224-I251 HydrophobicContact CE2-CD1 4.06Å; F224-I251 HydrophobicContact CE2-CG1 4.23Å; R248-I251 PolarHBondContact O-N 2.82Å; N249-I251 VanDerWaalsContact C-N 3.33Å
252	V	95.6	Very high	89.9	Confident	15 Å²	15	39.2 Å²	39.2	9%	0.091	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.6	-176.2	-176.3	0	0	0	0	108.4	L88 P91 I92 H94 V255 F313	L88-V252 HydrophobicContact CD1-CG1 4.3Å; P91-V252 WeakPolarHBondContact CA-O 3.25Å; I92-V252 HydrophobicContact CG1-CB 3.82Å; I92-V252 HydrophobicContact CG1-CG1 4.35Å; I92-V252 PolarHBondContact N-O 2.92Å; I92-V252 PolarHBondContact O-N 3.47Å; H94-V252 HydrophobicContact CB-CG2 3.73Å; V252-V255 HydrophobicContact CG1-CG2 3.84Å; V252-F313 HydrophobicContact CB-CZ 4.41Å; V252-F313 HydrophobicContact CG1-CE2 4.11Å; V252-F313 HydrophobicContact CG1-CZ 4.07Å; V252-F313 HydrophobicContact CG2-CE1 3.99Å; V252-F313 HydrophobicContact CG2-CZ 3.84Å
253	Q	94.4	Very high	91.2	Very high	59 Å²	59	30.8 Å²	30.8	28%	0.276	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-21.2	166	-167.9	168.4	21.7	0	0	111.8	L88 M221	L88-Q253 PolarHBondContact N-O 2.82Å; M221-Q253 HydrophobicContact CE-CB 4.32Å
254	R	96.5	Very high	92.2	Very high	37 Å²	37	30.1 Å²	30.1	14%	0.14	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.4	175.2	-175.8	172.1	-77	139.9	9.1	109.7	E24 L27 Y85 F86 D87	E24-R254 HydrophobicContact CG-CB 4.15Å; E24-R254 PolarHBondContact O-NH1 3.32Å; L27-R254 HydrophobicContact CD2-CB 4.22Å; L27-R254 HydrophobicContact CD2-CG 3.6Å; L27-R254 HydrophobicContact CG-CG 4.16Å; Y85-R254 HydrophobicContact CD2-CG 3.58Å; Y85-R254 HydrophobicContact CE2-CG 4.47Å; Y85-R254 VanDerWaalsContact CE2-NE 3.3Å; Y85-R254 HydrophobicContact CG-CG 3.96Å; F86-R254 WeakPolarHBondContact O-CA 3.19Å; D87-R254 WeakPolarHBondContact OD1-CB 3.3Å; D87-R254 WeakPolarHBondContact OD1-CG 3.31Å; D87-R254 IonicContact OD1-CZ 3.59Å; D87-R254 VanDerWaalsContact OD1-CZ 3.22Å; D87-R254 IonicContact OD1-NE 3.7Å; D87-R254 PolarHBondContact OD1-NE 3.35Å; D87-R254 IonicContact OD1-NH2 3.05Å; D87-R254 PolarHBondContact OD1-NH2 2.94Å; D87-R254 IonicContact OD2-CZ 2.55Å; D87-R254 IonicContact OD2-NE 3.81Å; D87-R254 IonicContact OD2-NH2 3.21Å; D87-R254 PolarHBondContact OD2-NH2 3.39Å
255	V	96.7	Very high	92.8	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.9	-179.1	179.5	0	0	0	0	109.3	Y85 F86 L88 V252 Y283 F313 L316	Y85-V255 CarbonylContact C-O 3.6Å; Y85-V255 VanDerWaalsContact CA-O 3.24Å; Y85-V255 WeakPolarHBondContact CA-O 3.31Å; F86-V255 HydrophobicContact CD1-CB 4.44Å; F86-V255 HydrophobicContact CD2-CB 4.06Å; F86-V255 HydrophobicContact CD2-CG2 4.42Å; F86-V255 HydrophobicContact CE1-CB 3.97Å; F86-V255 HydrophobicContact CE1-CG1 3.84Å; F86-V255 HydrophobicContact CE2-CB 3.54Å; F86-V255 HydrophobicContact CE2-CG1 4.06Å; F86-V255 HydrophobicContact CE2-CG2 3.73Å; F86-V255 HydrophobicContact CG-CB 4.48Å; F86-V255 HydrophobicContact CZ-CB 3.5Å; F86-V255 HydrophobicContact CZ-CG1 3.48Å; F86-V255 VanDerWaalsContact CZ-CG1 3.48Å; F86-V255 HydrophobicContact CZ-CG2 4.02Å; F86-V255 PolarHBondContact N-O 2.98Å; F86-V255 PolarHBondContact O-N 3.19Å; L88-V255 HydrophobicContact CD1-CG2 3.77Å; L88-V255 HydrophobicContact CD2-CG2 4.14Å; L88-V255 HydrophobicContact CG-CG2 3.89Å; V252-V255 HydrophobicContact CG1-CG2 3.84Å; V255-Y283 HydrophobicContact CG1-CD1 4.42Å; V255-Y283 HydrophobicContact CG1-CE1 4.11Å; V255-F313 HydrophobicContact CG1-CE2 4.1Å; V255-F313 HydrophobicContact CG2-CD2 4.11Å; V255-F313 HydrophobicContact CG2-CE2 3.93Å; V255-L316 HydrophobicContact CG1-CD2 4.45Å
256	P	96.7	Very high	92.8	Very high	47 Å²	47	31.4 Å²	31.4	31%	0.305	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.5	173.2	28.8	-33.5	0	0	0	110.4	L27 W83 Y283	L27-P256 HydrophobicContact CD1-CB 3.65Å; L27-P256 HydrophobicContact CD2-CB 3.92Å; L27-P256 HydrophobicContact CD2-CG 4.36Å; L27-P256 HydrophobicContact CG-CB 4.46Å; W83-P256 HydrophobicContact CE3-CB 4.12Å; W83-P256 HydrophobicContact CZ3-CB 4.05Å; P256-Y283 WeakPolarHBondContact O-CE1 3.31Å; P256-Y283 PolarHBondContact O-OH 3.01Å
257	V	96.9	Very high	92	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.7	168.2	-179.1	0	0	0	0	107.9	V35 L55 L60 G84 F86 Y283	V35-V257 HydrophobicContact CB-CG2 4.4Å; V35-V257 HydrophobicContact CG2-CB 4.41Å; V35-V257 HydrophobicContact CG2-CG1 4.44Å; V35-V257 HydrophobicContact CG2-CG2 4Å; L55-V257 HydrophobicContact CD2-CG1 4Å; L55-V257 HydrophobicContact CD2-CG2 4.26Å; L60-V257 HydrophobicContact CD1-CG1 4.13Å; G84-V257 PolarHBondContact N-O 3.47Å; G84-V257 PolarHBondContact O-N 3.13Å; F86-V257 HydrophobicContact CD1-CG2 3.41Å; F86-V257 VanDerWaalsContact CD1-CG2 3.41Å; F86-V257 HydrophobicContact CE1-CG2 3.69Å; V257-Y283 HydrophobicContact CG1-CD2 4.42Å; V257-Y283 HydrophobicContact CG1-CE2 4.42Å
258	C	95.6	Very high	90.8	Very high	6 Å²	6	36.2 Å²	36.2	4%	0.041	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-68	150	-178.9	64.3	0	0	0	0	111.5	W83 I262 Y283	W83-C258 HydrophobicContact CZ3-CB 4.2Å; C258-I262 HydrophobicContact CB-CB 4.09Å; C258-I262 HydrophobicContact CB-CD1 4.18Å; C258-I262 HydrophobicContact CB-CG2 4.19Å; C258-Y283 PolarHBondContact N-OH 3.32Å
259	P	95.6	Very high	89.2	Confident	5 Å²	5	41.8 Å²	41.8	3%	0.032	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-54.9	153.4	171.4	-25.4	32.3	0	0	0	113.8	H82 W83 A261 I262	H82-P259 WeakPolarHBondContact O-CA 3.32Å; W83-P259 HydrophobicContact CD2-CG 4.24Å; W83-P259 HydrophobicContact CG-CG 4.24Å; P259-A261 PolarHBondContact O-N 3.41Å; P259-A261 VanDerWaalsContact O-N 3.12Å; P259-I262 WeakPolarHBondContact O-CB 3.24Å; P259-I262 PolarHBondContact O-N 3.47Å
260	S	92.1	Very high	87.7	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.042	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-38.4	173.2	-77.2	0	0	0	0	114.2	L60 G61 N63 I262 G263	L60-S260 PolarHBondContact O-N 3.34Å; G61-S260 PolarHBondContact O-OG 3.16Å; N63-S260 PolarHBondContact ND2-OG 3.24Å; N63-S260 WeakPolarHBondContact OD1-CB 3.22Å; N63-S260 PolarHBondContact OD1-OG 2.89Å; S260-I262 PolarHBondContact O-N 2.67Å; S260-I262 VanDerWaalsContact O-N 3.14Å; S260-G263 CarbonylContact O-C 3.6Å; S260-G263 VanDerWaalsContact O-C 3.26Å; S260-G263 PolarHBondContact O-N 2.82Å; S260-G263 VanDerWaalsContact O-N 3.15Å
261	A	91.4	Very high	85.9	Confident	68 Å²	68	56.4 Å²	56.4	56%	0.562	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.6	178.9	0	0	0	0	0	113.9	P259	P259-A261 PolarHBondContact O-N 3.41Å; P259-A261 VanDerWaalsContact O-N 3.12Å
262	I	93.4	Very high	84.3	Confident	78 Å²	78	60.3 Å²	60.3	40%	0.4	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-28.7	178.7	-57.5	-171.5	0	0	0	111.7	C258 P259 S260 P264 L279 R339	C258-I262 HydrophobicContact CB-CB 4.09Å; C258-I262 HydrophobicContact CB-CD1 4.18Å; C258-I262 HydrophobicContact CB-CG2 4.19Å; P259-I262 WeakPolarHBondContact O-CB 3.24Å; P259-I262 PolarHBondContact O-N 3.47Å; S260-I262 PolarHBondContact O-N 2.67Å; S260-I262 VanDerWaalsContact O-N 3.14Å; I262-P264 VanDerWaalsContact C-CD 3.44Å; I262-P264 WeakPolarHBondContact O-CD 3.29Å; I262-L279 HydrophobicContact CG2-CD1 4.17Å; I262-R339 PolarHBondContact O-NH1 2.73Å
263	G	85.8	Confident	83.2	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.355	C	S	.	.	S	Bend	trans	-124	62.9	179.8	0	0	0	0	0	112.6	S260	S260-G263 CarbonylContact O-C 3.6Å; S260-G263 VanDerWaalsContact O-C 3.26Å; S260-G263 PolarHBondContact O-N 2.82Å; S260-G263 VanDerWaalsContact O-N 3.15Å
264	P	85.4	Confident	82.3	Confident	65 Å²	65	59.1 Å²	59.1	42%	0.422	35%	0.349	S	S	.	.			trans	-68.2	141.1	-174	28.9	-35.7	0	0	0	112.2	I262	I262-P264 VanDerWaalsContact C-CD 3.44Å; I262-P264 WeakPolarHBondContact O-CD 3.29Å
265	S	85.4	Confident	81.6	Confident	25 Å²	25	61.6 Å²	61.6	18%	0.175	37%	0.365	C	S	.	.			trans	-75.8	132.4	169.7	-50.9	0	0	0	0	110.5	E276	S265-E276 VanDerWaalsContact CB-OE2 3.24Å; S265-E276 WeakPolarHBondContact CB-OE2 3.33Å; S265-E276 PolarHBondContact OG-OE2 2.65Å
266	V	82.3	Confident	81.2	Confident	91 Å²	91	62.2 Å²	62.2	55%	0.552	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.6	176.3	-177.8	0	0	0	0	109.2	S268 N275	V266-S268 PolarHBondContact O-N 2.91Å; V266-N275 PolarHBondContact N-O 2.77Å; V266-N275 PolarHBondContact O-N 3.07Å
267	V	73.9	Confident	80.9	Confident	111 Å²	111	61.2 Å²	61.2	67%	0.673	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	125.8	172.6	-175.3	0	0	0	0	108.5	T274	V267-T274 HydrophobicContact CG2-CG2 4.48Å
268	S	70.7	Confident	80.7	Confident	22 Å²	22	62.3 Å²	62.3	15%	0.154	37%	0.366	C	S	.	.			trans	-85.5	119.1	176.4	158.1	0	0	0	0	108.9	V266 V270 R271 G273	V266-S268 PolarHBondContact O-N 2.91Å; S268-V270 VanDerWaalsContact C-N 3.33Å; S268-R271 VanDerWaalsContact CB-O 3.23Å; S268-R271 WeakPolarHBondContact CB-O 3.41Å; S268-R271 VanDerWaalsContact O-O 3.13Å; S268-R271 PolarHBondContact OG-N 3.36Å; S268-R271 PolarHBondContact OG-O 2.68Å; S268-G273 PolarHBondContact N-O 3.46Å
269	E	60.6	Low	80.7	Confident	197 Å²	197	62 Å²	62	92%	0.921	37%	0.365	S	S	*	.	S	Bend	trans	-70.8	-30.5	176.2	-65.8	179.6	177.4	0	0	112.2
270	V	61.8	Low	80.6	Confident	140 Å²	140	62 Å²	62	85%	0.848	36%	0.364	S	S	*	.	S	Bend	trans	-89	-39	-170.3	-175.7	0	0	0	0	112.5	S268	S268-V270 VanDerWaalsContact C-N 3.33Å
271	R	57.8	Low	80.6	Confident	206 Å²	206	64.5 Å²	64.5	78%	0.777	37%	0.374	S	S	*	.	S	Bend	trans	-116.5	118.1	175.4	-62.1	-174.8	-166.7	-165.8	2.2	107.3	S268 G273	S268-R271 VanDerWaalsContact CB-O 3.23Å; S268-R271 WeakPolarHBondContact CB-O 3.41Å; S268-R271 VanDerWaalsContact O-O 3.13Å; S268-R271 PolarHBondContact OG-N 3.36Å; S268-R271 PolarHBondContact OG-O 2.68Å; R271-G273 PolarHBondContact O-N 3Å
272	G	61.3	Low	80.7	Confident	88 Å²	88	61.3 Å²	61.3	91%	0.907	35%	0.347	S	S	*	.	S	Bend	trans	-48.9	116	178.3	0	0	0	0	0	110.7
273	G	72.3	Confident	80.8	Confident	21 Å²	21	57.8 Å²	57.8	22%	0.216	33%	0.329	C	S	.	.	S	Bend	trans	141.2	-176.2	179.4	0	0	0	0	0	115.2	S268 R271	S268-G273 PolarHBondContact N-O 3.46Å; R271-G273 PolarHBondContact O-N 3Å
274	T	75.4	Confident	81.2	Confident	27 Å²	27	60.2 Å²	60.2	17%	0.166	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.8	177	58.2	0	0	0	0	110.6	Y41 R48 V267 E276	Y41-T274 PolarHBondContact OH-OG1 3.18Å; Y41-T274 VanDerWaalsContact OH-OG1 3.1Å; R48-T274 PolarHBondContact NH2-OG1 3.32Å; V267-T274 HydrophobicContact CG2-CG2 4.48Å; T274-E276 VanDerWaalsContact CB-OE1 3.26Å; T274-E276 WeakPolarHBondContact CB-OE1 3.37Å; T274-E276 PolarHBondContact OG1-OE1 3.08Å
275	N	83.4	Confident	81.5	Confident	89 Å²	89	61.1 Å²	61.1	48%	0.476	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	110.7	166.5	-81.8	-35.7	0	0	0	108.4	V266	V266-N275 PolarHBondContact N-O 2.77Å; V266-N275 PolarHBondContact O-N 3.07Å
276	E	86.8	Confident	82	Confident	14 Å²	14	60 Å²	60	7%	0.065	33%	0.327	C	S	.	.			trans	-78.4	147	176.6	-51.3	-52.7	149.1	0	0	111.8	L40 Y41 S265 T274 I280 K281	L40-E276 HydrophobicContact CD1-CG 3.82Å; Y41-E276 PolarHBondContact OH-OE1 3.44Å; S265-E276 VanDerWaalsContact CB-OE2 3.24Å; S265-E276 WeakPolarHBondContact CB-OE2 3.33Å; S265-E276 PolarHBondContact OG-OE2 2.65Å; T274-E276 VanDerWaalsContact CB-OE1 3.26Å; T274-E276 WeakPolarHBondContact CB-OE1 3.37Å; T274-E276 PolarHBondContact OG1-OE1 3.08Å; E276-I280 HydrophobicContact CB-CB 4.45Å; E276-I280 HydrophobicContact CB-CG2 4.41Å; E276-K281 WeakPolarHBondContact O-CE 3.47Å
277	D	91.9	Very high	82.6	Confident	26 Å²	26	56.3 Å²	56.3	14%	0.139	31%	0.305	C	S	.	.			trans	-60.1	147.4	175.3	-175.9	-86.5	0	0	0	111.7	L279 I280 K281 R339	D277-L279 PolarHBondContact O-N 3.44Å; D277-L279 WeakPolarHBondContact OD1-CB 3.26Å; D277-L279 WeakPolarHBondContact OD1-CG 3.36Å; D277-L279 PolarHBondContact OD1-N 3.25Å; D277-I280 HydrophobicContact CB-CG1 4.37Å; D277-I280 PolarHBondContact O-N 2.75Å; D277-I280 VanDerWaalsContact O-N 3.1Å; D277-K281 PolarHBondContact O-N 2.8Å; D277-R339 IonicContact OD1-CZ 3.89Å; D277-R339 VanDerWaalsContact OD1-CZ 3.25Å; D277-R339 IonicContact OD1-NH1 3.9Å; D277-R339 PolarHBondContact OD1-NH1 2.84Å; D277-R339 IonicContact OD1-NH2 2.82Å; D277-R339 PolarHBondContact OD1-NH2 3.48Å; D277-R339 IonicContact OD2-CZ 3.85Å; D277-R339 IonicContact OD2-NH1 2.65Å; D277-R339 PolarHBondContact OD2-NH1 3.48Å; D277-R339 VanDerWaalsContact OD2-NH1 3.09Å; D277-R339 IonicContact OD2-NH2 3.81Å; D277-R339 PolarHBondContact OD2-NH2 3.25Å
278	D	92.6	Very high	83.5	Confident	24 Å²	24	52.7 Å²	52.7	13%	0.128	29%	0.286	C	S	.	.	H	α-helix	trans	-55.9	-34.8	-178.5	-64.4	-24.9	0	0	0	112.8	K281 M282 R334	D278-K281 PolarHBondContact O-N 2.87Å; D278-M282 VanDerWaalsContact O-CG 3.26Å; D278-M282 WeakPolarHBondContact O-CG 3.46Å; D278-M282 PolarHBondContact O-N 3.02Å; D278-R334 PolarHBondContact OD2-N 3.36Å
279	L	94.5	Very high	84.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-40	179.6	-63.1	177.8	0	0	0	111.5	I262 D277 K281 M282 Y283 L316 L336	I262-L279 HydrophobicContact CG2-CD1 4.17Å; D277-L279 PolarHBondContact O-N 3.44Å; D277-L279 WeakPolarHBondContact OD1-CB 3.26Å; D277-L279 WeakPolarHBondContact OD1-CG 3.36Å; D277-L279 PolarHBondContact OD1-N 3.25Å; L279-K281 VanDerWaalsContact C-N 3.3Å; L279-K281 PolarHBondContact O-N 3.11Å; L279-M282 HydrophobicContact CD2-SD 4.28Å; L279-M282 PolarHBondContact O-N 3.3Å; L279-Y283 HydrophobicContact CB-CE2 4.28Å; L279-Y283 WeakPolarHBondContact O-CD2 3.48Å; L279-Y283 PolarHBondContact O-N 3.28Å; L279-L316 HydrophobicContact CD2-CD1 3.83Å; L279-L336 HydrophobicContact CD1-CD2 4Å; L279-L336 HydrophobicContact CD2-CD2 3.95Å; L279-L336 HydrophobicContact CD2-CG 4.3Å
280	I	94	Very high	86.1	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-42.3	177.7	-59.8	-58.8	0	0	0	110.1	L40 L55 L56 E276 D277 Y283 Q284	L40-I280 HydrophobicContact CD1-CG2 4.42Å; L40-I280 HydrophobicContact CD2-CG2 3.66Å; L55-I280 HydrophobicContact CB-CG2 4.29Å; L55-I280 HydrophobicContact CD1-CG2 4.48Å; L56-I280 HydrophobicContact CD2-CD1 4.29Å; L56-I280 HydrophobicContact CD2-CG1 4.36Å; L56-I280 HydrophobicContact CD2-CG2 4.16Å; E276-I280 HydrophobicContact CB-CB 4.45Å; E276-I280 HydrophobicContact CB-CG2 4.41Å; D277-I280 HydrophobicContact CB-CG1 4.37Å; D277-I280 PolarHBondContact O-N 2.75Å; D277-I280 VanDerWaalsContact O-N 3.1Å; I280-Y283 PolarHBondContact O-N 2.94Å; I280-Q284 WeakPolarHBondContact O-CB 2.96Å; I280-Q284 PolarHBondContact O-N 3.38Å
281	K	91.8	Very high	87.6	Confident	60 Å²	60	40.2 Å²	40.2	26%	0.261	23%	0.225	S	C	.	.	H	α-helix	trans	-64.6	-41.3	175.6	-64.3	179.5	-178.4	174.7	0	112.3	E276 D277 D278 L279 Q284 W285	E276-K281 WeakPolarHBondContact O-CE 3.47Å; D277-K281 PolarHBondContact O-N 2.8Å; D278-K281 PolarHBondContact O-N 2.87Å; L279-K281 VanDerWaalsContact C-N 3.3Å; L279-K281 PolarHBondContact O-N 3.11Å; K281-Q284 WeakPolarHBondContact O-CB 3.45Å; K281-Q284 PolarHBondContact O-N 3.4Å; K281-W285 PolarHBondContact O-N 2.91Å
282	M	93.5	Very high	89.2	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-43.7	175.9	-69.4	169.9	180	0	0	111.8	D278 L279 Q284 W285 I286 L316 T333	D278-M282 VanDerWaalsContact O-CG 3.26Å; D278-M282 WeakPolarHBondContact O-CG 3.46Å; D278-M282 PolarHBondContact O-N 3.02Å; L279-M282 HydrophobicContact CD2-SD 4.28Å; L279-M282 PolarHBondContact O-N 3.3Å; M282-Q284 VanDerWaalsContact C-N 3.3Å; M282-Q284 PolarHBondContact O-N 3.18Å; M282-W285 PolarHBondContact O-N 3.43Å; M282-I286 VanDerWaalsContact O-CG1 3.29Å; M282-I286 WeakPolarHBondContact O-CG1 3.24Å; M282-I286 PolarHBondContact O-N 2.9Å; M282-L316 HydrophobicContact CB-CB 4.42Å; M282-L316 HydrophobicContact CB-CD1 3.96Å; M282-L316 VanDerWaalsContact SD-CA 3.58Å; M282-L316 HydrophobicContact SD-CB 4.37Å; M282-L316 HydrophobicContact SD-CD1 4.1Å; M282-T333 VanDerWaalsContact CE-CB 3.45Å; M282-T333 WeakPolarHBondContact CE-OG1 3.18Å
283	Y	96.1	Very high	90.6	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.02	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-40.1	173.9	-68.5	-55.3	0	0	0	112.1	L55 F86 V255 P256 V257 C258 L279 I280 W285 I286 L287 L316	L55-Y283 HydrophobicContact CD2-CD2 4.43Å; L55-Y283 HydrophobicContact CD2-CG 4.19Å; F86-Y283 AromaticContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CG 4.46Å; F86-Y283 HydrophobicContact CZ-CD1 4.18Å; V255-Y283 HydrophobicContact CG1-CD1 4.42Å; V255-Y283 HydrophobicContact CG1-CE1 4.11Å; P256-Y283 WeakPolarHBondContact O-CE1 3.31Å; P256-Y283 PolarHBondContact O-OH 3.01Å; V257-Y283 HydrophobicContact CG1-CD2 4.42Å; V257-Y283 HydrophobicContact CG1-CE2 4.42Å; C258-Y283 PolarHBondContact N-OH 3.32Å; L279-Y283 HydrophobicContact CB-CE2 4.28Å; L279-Y283 WeakPolarHBondContact O-CD2 3.48Å; L279-Y283 PolarHBondContact O-N 3.28Å; I280-Y283 PolarHBondContact O-N 2.94Å; Y283-W285 VanDerWaalsContact C-N 3.34Å; Y283-W285 PolarHBondContact O-N 2.89Å; Y283-I286 PolarHBondContact O-N 3.44Å; Y283-L287 WeakPolarHBondContact O-CB 3.4Å; Y283-L287 WeakPolarHBondContact O-CG 3.45Å; Y283-L287 PolarHBondContact O-N 2.97Å; Y283-L316 HydrophobicContact CD1-CD1 4.43Å; Y283-L316 HydrophobicContact CD1-CD2 4.09Å; Y283-L316 HydrophobicContact CE1-CD1 4.03Å; Y283-L316 HydrophobicContact CE1-CD2 3.57Å; Y283-L316 HydrophobicContact CE1-CG 4.46Å
284	Q	93.9	Very high	91.4	Very high	50 Å²	50	35.5 Å²	35.5	23%	0.234	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-44.4	176.3	172.1	173.1	66.5	0	0	111.5	C38 L55 I280 K281 M282 L287 A288	C38-Q284 HydrophobicContact CB-CG 4.49Å; C38-Q284 WeakPolarHBondContact O-CG 3.3Å; C38-Q284 PolarHBondContact O-NE2 3.3Å; L55-Q284 HydrophobicContact CD1-CB 3.81Å; I280-Q284 WeakPolarHBondContact O-CB 2.96Å; I280-Q284 PolarHBondContact O-N 3.38Å; K281-Q284 WeakPolarHBondContact O-CB 3.45Å; K281-Q284 PolarHBondContact O-N 3.4Å; M282-Q284 VanDerWaalsContact C-N 3.3Å; M282-Q284 PolarHBondContact O-N 3.18Å; Q284-L287 PolarHBondContact O-N 3.48Å; Q284-A288 WeakPolarHBondContact O-CB 3.34Å; Q284-A288 PolarHBondContact O-N 3.44Å
285	W	92.5	Very high	92.1	Very high	85 Å²	85	39.9 Å²	39.9	32%	0.322	21%	0.205	S	C	.	.	H	α-helix	trans	-65	-41.2	176.5	-64.9	-26.1	0	0	0	112.7	K281 M282 Y283 A288 Q289 E312 V327	K281-W285 PolarHBondContact O-N 2.91Å; M282-W285 PolarHBondContact O-N 3.43Å; Y283-W285 VanDerWaalsContact C-N 3.34Å; Y283-W285 PolarHBondContact O-N 2.89Å; W285-A288 PolarHBondContact O-N 3.34Å; W285-Q289 WeakPolarHBondContact O-CG 3.35Å; W285-Q289 PolarHBondContact O-N 3.37Å; W285-E312 HydrophobicContact CB-CG 4.16Å; W285-V327 HydrophobicContact CH2-CG1 4.28Å
286	I	95.1	Very high	92.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.9	-46.6	175.8	-64.4	165.6	0	0	0	110.5	F86 L88 M282 Y283 A288 Q289 A290 L309 E312 F313 L316	F86-I286 HydrophobicContact CE2-CB 4.46Å; F86-I286 HydrophobicContact CE2-CG2 3.57Å; F86-I286 HydrophobicContact CZ-CB 4.15Å; F86-I286 HydrophobicContact CZ-CG2 3.66Å; L88-I286 HydrophobicContact CD2-CG2 3.91Å; M282-I286 VanDerWaalsContact O-CG1 3.29Å; M282-I286 WeakPolarHBondContact O-CG1 3.24Å; M282-I286 PolarHBondContact O-N 2.9Å; Y283-I286 PolarHBondContact O-N 3.44Å; I286-A288 VanDerWaalsContact C-N 3.34Å; I286-A288 PolarHBondContact O-N 3.38Å; I286-Q289 PolarHBondContact O-N 3.41Å; I286-A290 WeakPolarHBondContact O-CB 3.27Å; I286-A290 PolarHBondContact O-N 2.85Å; I286-L309 HydrophobicContact CG2-CD1 3.77Å; I286-E312 HydrophobicContact CG1-CB 3.69Å; I286-F313 HydrophobicContact CD1-CB 4.44Å; I286-F313 HydrophobicContact CD1-CD2 4.27Å; I286-L316 HydrophobicContact CD1-CB 4.11Å; I286-L316 HydrophobicContact CD1-CD2 3.86Å
287	L	95	Very high	92.2	Very high	14 Å²	14	44.8 Å²	44.8	7%	0.073	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-39.1	177.8	-79.2	169.8	0	0	0	112.3	V35 C38 L55 F86 Y283 Q284 A290 A291	V35-L287 HydrophobicContact CG1-CD1 3.74Å; C38-L287 HydrophobicContact CB-CB 3.74Å; L55-L287 HydrophobicContact CD1-CD1 4.1Å; L55-L287 HydrophobicContact CD2-CD1 3.89Å; L55-L287 HydrophobicContact CG-CD1 3.98Å; F86-L287 HydrophobicContact CB-CD2 3.76Å; F86-L287 HydrophobicContact CD1-CD1 4.31Å; F86-L287 HydrophobicContact CD1-CD2 3.89Å; F86-L287 HydrophobicContact CD1-CG 4.09Å; F86-L287 HydrophobicContact CD2-CD2 3.61Å; F86-L287 HydrophobicContact CD2-CG 4.27Å; F86-L287 HydrophobicContact CE1-CD1 4.5Å; F86-L287 HydrophobicContact CE1-CD2 4.38Å; F86-L287 HydrophobicContact CE1-CG 4.15Å; F86-L287 HydrophobicContact CE2-CD2 4.11Å; F86-L287 HydrophobicContact CE2-CG 4.31Å; F86-L287 HydrophobicContact CG-CD2 3.49Å; F86-L287 VanDerWaalsContact CG-CD2 3.49Å; F86-L287 HydrophobicContact CG-CG 4.16Å; F86-L287 HydrophobicContact CZ-CD2 4.47Å; F86-L287 HydrophobicContact CZ-CG 4.25Å; Y283-L287 WeakPolarHBondContact O-CB 3.4Å; Y283-L287 WeakPolarHBondContact O-CG 3.45Å; Y283-L287 PolarHBondContact O-N 2.97Å; Q284-L287 PolarHBondContact O-N 3.48Å; L287-A290 PolarHBondContact O-N 3.23Å; L287-A291 WeakPolarHBondContact O-CB 3.49Å; L287-A291 PolarHBondContact O-N 3.18Å
288	A	93.1	Very high	92	Very high	35 Å²	35	45.6 Å²	45.6	29%	0.289	25%	0.246	S	C	.	.	H	α-helix	trans	-64	-47	176.2	0	0	0	0	0	111.5	Q284 W285 I286 A290 A291 T292	Q284-A288 WeakPolarHBondContact O-CB 3.34Å; Q284-A288 PolarHBondContact O-N 3.44Å; W285-A288 PolarHBondContact O-N 3.34Å; I286-A288 VanDerWaalsContact C-N 3.34Å; I286-A288 PolarHBondContact O-N 3.38Å; A288-A290 VanDerWaalsContact C-N 3.31Å; A288-A290 PolarHBondContact O-N 3.44Å; A288-A291 PolarHBondContact O-N 3.23Å; A288-T292 PolarHBondContact O-N 3.01Å; A288-T292 PolarHBondContact O-OG1 3.15Å; A288-T292 VanDerWaalsContact O-OG1 3.12Å
289	Q	91.9	Very high	91.6	Very high	47 Å²	47	52.1 Å²	52.1	22%	0.22	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-38.1	175.8	-68.9	-61.4	-37.4	0	0	112.1	W285 I286 T292 I293 L309 E312	W285-Q289 WeakPolarHBondContact O-CG 3.35Å; W285-Q289 PolarHBondContact O-N 3.37Å; I286-Q289 PolarHBondContact O-N 3.41Å; Q289-T292 PolarHBondContact O-N 3.06Å; Q289-I293 WeakPolarHBondContact O-CG1 3.26Å; Q289-I293 PolarHBondContact O-N 3.38Å; Q289-L309 HydrophobicContact CB-CB 4.36Å; Q289-L309 HydrophobicContact CB-CD1 4.02Å; Q289-E312 HydrophobicContact CG-CG 4.21Å
290	A	93.5	Very high	91.2	Very high	6 Å²	6	55.8 Å²	55.8	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-47	174.7	0	0	0	0	0	111.6	L88 P89 I286 L287 A288 T292 I293 E294	L88-A290 HydrophobicContact CD2-CB 4.3Å; P89-A290 HydrophobicContact CG-CB 4.26Å; I286-A290 WeakPolarHBondContact O-CB 3.27Å; I286-A290 PolarHBondContact O-N 2.85Å; L287-A290 PolarHBondContact O-N 3.23Å; A288-A290 VanDerWaalsContact C-N 3.31Å; A288-A290 PolarHBondContact O-N 3.44Å; A290-T292 VanDerWaalsContact C-N 3.34Å; A290-T292 PolarHBondContact O-N 2.96Å; A290-I293 PolarHBondContact O-N 3.11Å; A290-I293 VanDerWaalsContact O-N 3.15Å; A290-E294 PolarHBondContact O-N 2.91Å
291	A	92.6	Very high	90.9	Very high	45 Å²	45	60.3 Å²	60.3	37%	0.372	33%	0.33	S	S	.	.	H	α-helix	trans	-60.4	-41.7	177.4	0	0	0	0	0	112.2	L287 A288 I293 E294 E295	L287-A291 WeakPolarHBondContact O-CB 3.49Å; L287-A291 PolarHBondContact O-N 3.18Å; A288-A291 PolarHBondContact O-N 3.23Å; A291-I293 VanDerWaalsContact C-N 3.28Å; A291-I293 PolarHBondContact O-N 3.17Å; A291-E294 PolarHBondContact O-N 3.2Å; A291-E294 VanDerWaalsContact O-N 3.11Å; A291-E295 PolarHBondContact O-N 3.29Å
292	T	92.3	Very high	90.6	Very high	49 Å²	49	61.4 Å²	61.4	30%	0.301	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-32	176.5	-54.6	0	0	0	0	113	A288 Q289 A290 E294 E295	A288-T292 PolarHBondContact O-N 3.01Å; A288-T292 PolarHBondContact O-OG1 3.15Å; A288-T292 VanDerWaalsContact O-OG1 3.12Å; Q289-T292 PolarHBondContact O-N 3.06Å; A290-T292 VanDerWaalsContact C-N 3.34Å; A290-T292 PolarHBondContact O-N 2.96Å; T292-E294 VanDerWaalsContact C-N 3.3Å; T292-E295 PolarHBondContact O-N 3.17Å
293	I	90.5	Very high	90.3	Very high	21 Å²	21	64.4 Å²	64.4	11%	0.108	35%	0.351	C	S	.	.	H	α-helix	trans	-71.5	-26.9	176.2	-68.7	167.6	0	0	0	111.9	P89 T90 Q289 A290 A291 E295 C305 L309	P89-I293 HydrophobicContact CB-CG2 4.25Å; P89-I293 HydrophobicContact CG-CB 3.95Å; P89-I293 HydrophobicContact CG-CG2 3.81Å; T90-I293 HydrophobicContact CG2-CG2 4.22Å; Q289-I293 WeakPolarHBondContact O-CG1 3.26Å; Q289-I293 PolarHBondContact O-N 3.38Å; A290-I293 PolarHBondContact O-N 3.11Å; A290-I293 VanDerWaalsContact O-N 3.15Å; A291-I293 VanDerWaalsContact C-N 3.28Å; A291-I293 PolarHBondContact O-N 3.17Å; I293-E295 VanDerWaalsContact C-N 3.3Å; I293-C305 HydrophobicContact CD1-CB 4.11Å; I293-C305 HydrophobicContact CG1-CB 3.54Å; I293-L309 HydrophobicContact CD1-CB 4.13Å; I293-L309 HydrophobicContact CD1-CD2 3.81Å
294	E	89.7	Confident	89.9	Confident	146 Å²	146	66.4 Å²	66.4	68%	0.682	37%	0.369	S	S	*	.	H	α-helix	trans	-78	-15.9	176.1	-67.3	-174.7	150.4	0	0	113	P89 A290 A291 T292	P89-E294 HydrophobicContact CB-CG 3.58Å; P89-E294 HydrophobicContact CG-CG 4.09Å; A290-E294 PolarHBondContact O-N 2.91Å; A291-E294 PolarHBondContact O-N 3.2Å; A291-E294 VanDerWaalsContact O-N 3.11Å; T292-E294 VanDerWaalsContact C-N 3.3Å
295	E	90.3	Very high	89.7	Confident	119 Å²	119	64.8 Å²	64.8	56%	0.556	36%	0.363	S	S	*	.	S	Bend	trans	-70.7	155.7	171.3	-64.3	179.3	177.2	0	0	111.1	A291 T292 I293 I297	A291-E295 PolarHBondContact O-N 3.29Å; T292-E295 PolarHBondContact O-N 3.17Å; I293-E295 VanDerWaalsContact C-N 3.3Å; E295-I297 HydrophobicContact CB-CG2 4.32Å; E295-I297 PolarHBondContact O-N 3.13Å
296	D	83.1	Confident	89.5	Confident	173 Å²	173	62.1 Å²	62.1	93%	0.925	36%	0.355	S	S	*	.			trans	-77.6	75.1	179	-165.8	21.3	0	0	0	110.6
297	I	87.3	Confident	89.3	Confident	32 Å²	32	64.4 Å²	64.4	16%	0.164	37%	0.367	C	S	.	.			trans	-99.1	151.6	178.1	54.3	163.6	0	0	0	111.2	E295 D301 Q302 C305	E295-I297 HydrophobicContact CB-CG2 4.32Å; E295-I297 PolarHBondContact O-N 3.13Å; I297-D301 HydrophobicContact CB-CB 4.3Å; I297-D301 HydrophobicContact CD1-CB 4.27Å; I297-Q302 HydrophobicContact CD1-CB 4.37Å; I297-Q302 HydrophobicContact CD1-CG 3.79Å; I297-Q302 HydrophobicContact CG1-CG 3.61Å; I297-Q302 PolarHBondContact O-NE2 3.46Å; I297-C305 HydrophobicContact CD1-CB 4.32Å
298	G	88.4	Confident	89	Confident	43 Å²	43	66.8 Å²	66.8	44%	0.443	38%	0.38	S	S	.	.			trans	-63.7	155.5	179.7	0	0	0	0	0	113.3	A300 D301 Q302	G298-A300 VanDerWaalsContact C-N 3.27Å; G298-A300 PolarHBondContact O-N 3.09Å; G298-A300 VanDerWaalsContact O-N 3.16Å; G298-D301 PolarHBondContact O-N 3.36Å; G298-Q302 WeakPolarHBondContact O-CG 3.43Å; G298-Q302 PolarHBondContact O-N 3.32Å
299	E	84.3	Confident	89	Confident	162 Å²	162	65.1 Å²	65.1	76%	0.757	37%	0.367	S	S	*	.	H	α-helix	trans	-55.6	-37.3	-174.9	-69.3	-171.3	166.2	0	0	114.1	Q302 I303	E299-Q302 PolarHBondContact O-N 3.36Å; E299-I303 WeakPolarHBondContact O-CG1 3.47Å; E299-I303 PolarHBondContact O-N 2.97Å
300	A	85.6	Confident	89	Confident	77 Å²	77	63.2 Å²	63.2	64%	0.636	36%	0.357	S	S	*	.	H	α-helix	trans	-65.2	-41.9	178	0	0	0	0	0	111.6	G298 I303 A304	G298-A300 VanDerWaalsContact C-N 3.27Å; G298-A300 PolarHBondContact O-N 3.09Å; G298-A300 VanDerWaalsContact O-N 3.16Å; A300-I303 PolarHBondContact O-N 3.05Å; A300-A304 PolarHBondContact O-N 2.92Å
301	D	88.6	Confident	88.9	Confident	98 Å²	98	63 Å²	63	52%	0.524	36%	0.356	S	S	.	.	H	α-helix	trans	-70	-37	178	-61.4	-38	0	0	0	111	I297 G298 I303 A304 C305	I297-D301 HydrophobicContact CB-CB 4.3Å; I297-D301 HydrophobicContact CD1-CB 4.27Å; G298-D301 PolarHBondContact O-N 3.36Å; D301-I303 VanDerWaalsContact C-N 3.28Å; D301-I303 PolarHBondContact O-N 2.85Å; D301-A304 PolarHBondContact O-N 3.15Å; D301-A304 VanDerWaalsContact O-N 3.14Å; D301-C305 WeakPolarHBondContact O-CB 3.49Å; D301-C305 PolarHBondContact O-N 3.14Å; D301-C305 PolarHBondContact O-SG 2.82Å; D301-C305 VanDerWaalsContact O-SG 3.39Å
302	Q	86.2	Confident	88.9	Confident	83 Å²	83	62 Å²	62	39%	0.388	34%	0.344	S	S	.	.	H	α-helix	trans	-57	-41.9	173.8	-69.5	179.2	10	0	0	112.1	I297 G298 E299 L306	I297-Q302 HydrophobicContact CD1-CB 4.37Å; I297-Q302 HydrophobicContact CD1-CG 3.79Å; I297-Q302 HydrophobicContact CG1-CG 3.61Å; I297-Q302 PolarHBondContact O-NE2 3.46Å; G298-Q302 WeakPolarHBondContact O-CG 3.43Å; G298-Q302 PolarHBondContact O-N 3.32Å; E299-Q302 PolarHBondContact O-N 3.36Å; Q302-L306 WeakPolarHBondContact O-CB 3.47Å; Q302-L306 PolarHBondContact O-N 2.97Å
303	I	85.8	Confident	89.1	Confident	62 Å²	62	60 Å²	60	32%	0.318	33%	0.331	S	S	.	.	H	α-helix	trans	-65.4	-44.5	177.5	-65.1	166.8	0	0	0	110.4	E299 A300 D301 L306 D307	E299-I303 WeakPolarHBondContact O-CG1 3.47Å; E299-I303 PolarHBondContact O-N 2.97Å; A300-I303 PolarHBondContact O-N 3.05Å; D301-I303 VanDerWaalsContact C-N 3.28Å; D301-I303 PolarHBondContact O-N 2.85Å; I303-L306 PolarHBondContact O-N 3.12Å; I303-D307 PolarHBondContact O-N 3.24Å
304	A	88.3	Confident	89.2	Confident	47 Å²	47	59.1 Å²	59.1	39%	0.388	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-44.4	178	0	0	0	0	0	112	A300 D301 L306 D307 N308	A300-A304 PolarHBondContact O-N 2.92Å; D301-A304 PolarHBondContact O-N 3.15Å; D301-A304 VanDerWaalsContact O-N 3.14Å; A304-L306 VanDerWaalsContact C-N 3.34Å; A304-L306 PolarHBondContact O-N 3.23Å; A304-D307 PolarHBondContact O-N 3.44Å; A304-N308 PolarHBondContact O-N 3.35Å; A304-N308 PolarHBondContact O-ND2 3.37Å
305	C	89.6	Confident	89.3	Confident	17 Å²	17	52.8 Å²	52.8	12%	0.115	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-40.3	175	-72.6	0	0	0	0	111.8	I293 I297 D301 D307 N308 L309	I293-C305 HydrophobicContact CD1-CB 4.11Å; I293-C305 HydrophobicContact CG1-CB 3.54Å; I297-C305 HydrophobicContact CD1-CB 4.32Å; D301-C305 WeakPolarHBondContact O-CB 3.49Å; D301-C305 PolarHBondContact O-N 3.14Å; D301-C305 PolarHBondContact O-SG 2.82Å; D301-C305 VanDerWaalsContact O-SG 3.39Å; C305-D307 PolarHBondContact O-N 3.47Å; C305-N308 PolarHBondContact O-N 3.47Å; C305-L309 WeakPolarHBondContact O-CB 3.38Å; C305-L309 PolarHBondContact O-N 2.77Å
306	L	88.9	Confident	89.6	Confident	28 Å²	28	47.3 Å²	47.3	15%	0.147	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-39.9	175.5	-178.7	61.1	0	0	0	112.4	T90 I92 Q302 I303 A304 L309 H310	T90-L306 WeakPolarHBondContact OG1-CD1 3.07Å; I92-L306 HydrophobicContact CG2-CD1 4.13Å; Q302-L306 WeakPolarHBondContact O-CB 3.47Å; Q302-L306 PolarHBondContact O-N 2.97Å; I303-L306 PolarHBondContact O-N 3.12Å; A304-L306 VanDerWaalsContact C-N 3.34Å; A304-L306 PolarHBondContact O-N 3.23Å; L306-L309 PolarHBondContact O-N 3.45Å; L306-H310 PolarHBondContact O-N 2.91Å; L306-H310 PolarHBondContact O-ND1 3.17Å
307	D	89.4	Confident	90.1	Very high	48 Å²	48	40.6 Å²	40.6	26%	0.257	24%	0.235	S	C	.	.	H	α-helix	trans	-65.1	-40.8	175.7	-79.2	-4.2	0	0	0	111	P173 Y174 I303 A304 C305 H310 A311	P173-D307 WeakPolarHBondContact CG-OD1 3.17Å; Y174-D307 WeakPolarHBondContact CE2-OD1 3.5Å; Y174-D307 WeakPolarHBondContact CE2-OD2 3.45Å; Y174-D307 PolarHBondContact OH-OD1 3.02Å; Y174-D307 PolarHBondContact OH-OD2 3.43Å; I303-D307 PolarHBondContact O-N 3.24Å; A304-D307 PolarHBondContact O-N 3.44Å; C305-D307 PolarHBondContact O-N 3.47Å; D307-H310 PolarHBondContact O-N 3.31Å; D307-A311 PolarHBondContact O-N 3.12Å
308	N	90.7	Very high	90.4	Very high	65 Å²	65	40.5 Å²	40.5	35%	0.348	24%	0.235	S	C	.	.	H	α-helix	trans	-64.1	-44.4	173.6	-71.1	-27.7	0	0	0	111.9	A304 C305 H310 A311 E312	A304-N308 PolarHBondContact O-N 3.35Å; A304-N308 PolarHBondContact O-ND2 3.37Å; C305-N308 PolarHBondContact O-N 3.47Å; N308-H310 VanDerWaalsContact C-N 3.32Å; N308-H310 PolarHBondContact O-N 2.7Å; N308-A311 WeakPolarHBondContact O-CA 3Å; N308-A311 WeakPolarHBondContact O-CB 3.49Å; N308-A311 PolarHBondContact O-N 3.1Å; N308-E312 WeakPolarHBondContact O-CG 3.46Å; N308-E312 PolarHBondContact O-N 3.18Å
309	L	92.5	Very high	90.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-44.5	176.7	-179.4	65.6	0	0	0	111.5	L88 I92 I286 Q289 I293 C305 L306 A311 E312 F313	L88-L309 HydrophobicContact CD2-CD1 4.1Å; L88-L309 HydrophobicContact CD2-CD2 4.31Å; I92-L309 HydrophobicContact CG2-CD2 3.82Å; I92-L309 HydrophobicContact CG2-CG 4.17Å; I286-L309 HydrophobicContact CG2-CD1 3.77Å; Q289-L309 HydrophobicContact CB-CB 4.36Å; Q289-L309 HydrophobicContact CB-CD1 4.02Å; I293-L309 HydrophobicContact CD1-CB 4.13Å; I293-L309 HydrophobicContact CD1-CD2 3.81Å; C305-L309 WeakPolarHBondContact O-CB 3.38Å; C305-L309 PolarHBondContact O-N 2.77Å; L306-L309 PolarHBondContact O-N 3.45Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A311 PolarHBondContact O-N 2.9Å; L309-E312 PolarHBondContact O-N 2.96Å; L309-F313 PolarHBondContact O-N 3.33Å
310	H	91.9	Very high	90.6	Very high	6 Å²	6	38 Å²	38	3%	0.028	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-39.8	174.2	-80.6	93.1	0	0	0	112.5	I92 Y93 P173 P217 L306 D307 N308 A314	I92-H310 VanDerWaalsContact CA-NE2 3.27Å; I92-H310 WeakPolarHBondContact CA-NE2 3.21Å; I92-H310 VanDerWaalsContact CB-NE2 3.3Å; I92-H310 WeakPolarHBondContact CB-NE2 3.49Å; I92-H310 VanDerWaalsContact CG2-CE1 3.47Å; I92-H310 WeakPolarHBondContact CG2-CE1 3.49Å; Y93-H310 PolarHBondContact N-NE2 2.64Å; P173-H310 HydrophobicContact CB-CB 4.18Å; P173-H310 HydrophobicContact CG-CB 4.38Å; P217-H310 WeakPolarHBondContact CG-NE2 3.39Å; L306-H310 PolarHBondContact O-N 2.91Å; L306-H310 PolarHBondContact O-ND1 3.17Å; D307-H310 PolarHBondContact O-N 3.31Å; N308-H310 VanDerWaalsContact C-N 3.32Å; N308-H310 PolarHBondContact O-N 2.7Å; H310-A314 WeakPolarHBondContact O-CB 3.42Å; H310-A314 PolarHBondContact O-N 3.09Å
311	A	91.5	Very high	90.6	Very high	3 Å²	3	36 Å²	36	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-64.2	-44.3	176.7	0	0	0	0	0	111.7	D307 N308 L309 A314 R315 L324 P325	D307-A311 PolarHBondContact O-N 3.12Å; N308-A311 WeakPolarHBondContact O-CA 3Å; N308-A311 WeakPolarHBondContact O-CB 3.49Å; N308-A311 PolarHBondContact O-N 3.1Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A311 PolarHBondContact O-N 2.9Å; A311-A314 PolarHBondContact O-N 3.31Å; A311-R315 WeakPolarHBondContact O-CG 3.12Å; A311-R315 PolarHBondContact O-N 3.44Å; A311-L324 HydrophobicContact CB-CD2 4.05Å; A311-L324 WeakPolarHBondContact O-CD2 3.5Å; A311-P325 HydrophobicContact CB-CG 3.77Å
312	E	93.1	Very high	90.3	Very high	24 Å²	24	36.5 Å²	36.5	11%	0.112	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-43.8	177.7	-62.6	-49.9	153.6	0	0	112.1	W285 I286 Q289 N308 L309 A314 R315 L316	W285-E312 HydrophobicContact CB-CG 4.16Å; I286-E312 HydrophobicContact CG1-CB 3.69Å; Q289-E312 HydrophobicContact CG-CG 4.21Å; N308-E312 WeakPolarHBondContact O-CG 3.46Å; N308-E312 PolarHBondContact O-N 3.18Å; L309-E312 PolarHBondContact O-N 2.96Å; E312-A314 VanDerWaalsContact C-N 3.3Å; E312-A314 PolarHBondContact O-N 2.98Å; E312-R315 PolarHBondContact O-N 2.72Å; E312-R315 IonicContact OE1-CZ 3.86Å; E312-R315 IonicContact OE1-NH1 2.95Å; E312-R315 PolarHBondContact OE1-NH1 3.16Å; E312-R315 IonicContact OE2-CZ 3.84Å; E312-R315 IonicContact OE2-NH1 3.22Å; E312-R315 PolarHBondContact OE2-NH1 3.42Å; E312-L316 PolarHBondContact O-N 3.23Å
313	F	94.5	Very high	90.1	Very high	7 Å²	7	35.5 Å²	35.5	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-38.7	173.9	-173.8	-97.6	0	0	0	112	I92 H94 V252 V255 I286 L309 R315 L316 I317	I92-F313 HydrophobicContact CD1-CB 3.41Å; I92-F313 VanDerWaalsContact CD1-CB 3.41Å; I92-F313 HydrophobicContact CD1-CD1 3.71Å; I92-F313 HydrophobicContact CD1-CD2 3.84Å; I92-F313 HydrophobicContact CD1-CE1 4.46Å; I92-F313 HydrophobicContact CD1-CG 3.35Å; H94-F313 AromaticContact CD2-CE1 3.9Å; H94-F313 AromaticContact CD2-CZ 3.99Å; V252-F313 HydrophobicContact CB-CZ 4.41Å; V252-F313 HydrophobicContact CG1-CE2 4.11Å; V252-F313 HydrophobicContact CG1-CZ 4.07Å; V252-F313 HydrophobicContact CG2-CE1 3.99Å; V252-F313 HydrophobicContact CG2-CZ 3.84Å; V255-F313 HydrophobicContact CG1-CE2 4.1Å; V255-F313 HydrophobicContact CG2-CD2 4.11Å; V255-F313 HydrophobicContact CG2-CE2 3.93Å; I286-F313 HydrophobicContact CD1-CB 4.44Å; I286-F313 HydrophobicContact CD1-CD2 4.27Å; L309-F313 PolarHBondContact O-N 3.33Å; F313-R315 VanDerWaalsContact C-N 3.33Å; F313-R315 PolarHBondContact O-N 3.06Å; F313-L316 HydrophobicContact CD2-CD2 4.36Å; F313-L316 HydrophobicContact CE2-CD2 4.34Å; F313-L316 WeakPolarHBondContact O-CB 3.28Å; F313-L316 PolarHBondContact O-N 2.75Å; F313-I317 HydrophobicContact CD1-CG1 4.43Å; F313-I317 HydrophobicContact CE1-CD1 4.44Å; F313-I317 HydrophobicContact CE1-CG1 3.94Å; F313-I317 HydrophobicContact CZ-CD1 4.19Å; F313-I317 HydrophobicContact CZ-CG1 4.18Å; F313-I317 PolarHBondContact O-N 2.88Å
314	A	93.5	Very high	89.9	Confident	2 Å²	2	34.1 Å²	34.1	2%	0.017	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-38.6	175.2	0	0	0	0	0	111.9	V95 L172 H310 A311 E312 L316 I317 N318 L324	V95-A314 HydrophobicContact CB-CB 4.1Å; V95-A314 HydrophobicContact CG1-CB 4.34Å; V95-A314 HydrophobicContact CG2-CB 3.83Å; L172-A314 HydrophobicContact CD1-CB 3.92Å; H310-A314 WeakPolarHBondContact O-CB 3.42Å; H310-A314 PolarHBondContact O-N 3.09Å; A311-A314 PolarHBondContact O-N 3.31Å; E312-A314 VanDerWaalsContact C-N 3.3Å; E312-A314 PolarHBondContact O-N 2.98Å; A314-L316 VanDerWaalsContact C-N 3.34Å; A314-L316 PolarHBondContact O-N 3.05Å; A314-I317 PolarHBondContact O-N 3.24Å; A314-N318 CarbonylContact O-C 3.34Å; A314-N318 PolarHBondContact O-N 3.35Å; A314-L324 HydrophobicContact CB-CD2 3.88Å
315	R	92.5	Very high	89.6	Confident	12 Å²	12	34.4 Å²	34.4	5%	0.045	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-38.9	174.1	-73.7	-176.4	-164.4	111	-7.2	112.6	A311 E312 F313 I317 S319 L324 P325 V327	A311-R315 WeakPolarHBondContact O-CG 3.12Å; A311-R315 PolarHBondContact O-N 3.44Å; E312-R315 PolarHBondContact O-N 2.72Å; E312-R315 IonicContact OE1-CZ 3.86Å; E312-R315 IonicContact OE1-NH1 2.95Å; E312-R315 PolarHBondContact OE1-NH1 3.16Å; E312-R315 IonicContact OE2-CZ 3.84Å; E312-R315 IonicContact OE2-NH1 3.22Å; E312-R315 PolarHBondContact OE2-NH1 3.42Å; F313-R315 VanDerWaalsContact C-N 3.33Å; F313-R315 PolarHBondContact O-N 3.06Å; R315-I317 VanDerWaalsContact C-N 3.32Å; R315-I317 PolarHBondContact O-N 3.21Å; R315-S319 PolarHBondContact O-N 3.42Å; R315-L324 HydrophobicContact CG-CD1 3.71Å; R315-L324 HydrophobicContact CG-CD2 3.91Å; R315-L324 HydrophobicContact CG-CG 4.41Å; R315-P325 PolarHBondContact NH2-O 3.36Å; R315-V327 VanDerWaalsContact NE-CG2 3.31Å
316	L	95	Very high	89	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-56.2	-47.1	174.8	177.6	69.4	0	0	0	111.6	V255 L279 M282 Y283 I286 E312 F313 A314 G335 L336	V255-L316 HydrophobicContact CG1-CD2 4.45Å; L279-L316 HydrophobicContact CD2-CD1 3.83Å; M282-L316 HydrophobicContact CB-CB 4.42Å; M282-L316 HydrophobicContact CB-CD1 3.96Å; M282-L316 VanDerWaalsContact SD-CA 3.58Å; M282-L316 HydrophobicContact SD-CB 4.37Å; M282-L316 HydrophobicContact SD-CD1 4.1Å; Y283-L316 HydrophobicContact CD1-CD1 4.43Å; Y283-L316 HydrophobicContact CD1-CD2 4.09Å; Y283-L316 HydrophobicContact CE1-CD1 4.03Å; Y283-L316 HydrophobicContact CE1-CD2 3.57Å; Y283-L316 HydrophobicContact CE1-CG 4.46Å; I286-L316 HydrophobicContact CD1-CB 4.11Å; I286-L316 HydrophobicContact CD1-CD2 3.86Å; E312-L316 PolarHBondContact O-N 3.23Å; F313-L316 HydrophobicContact CD2-CD2 4.36Å; F313-L316 HydrophobicContact CE2-CD2 4.34Å; F313-L316 WeakPolarHBondContact O-CB 3.28Å; F313-L316 PolarHBondContact O-N 2.75Å; A314-L316 VanDerWaalsContact C-N 3.34Å; A314-L316 PolarHBondContact O-N 3.05Å; L316-G335 CarbonylContact O-C 3.56Å; L316-G335 VanDerWaalsContact O-CA 3.32Å; L316-G335 WeakPolarHBondContact O-CA 3.25Å; L316-L336 PolarHBondContact O-N 3.44Å
317	I	95	Very high	88.1	Confident	32 Å²	32	40.8 Å²	40.8	16%	0.164	25%	0.247	C	C	.	.	H	α-helix	trans	-75.3	-51.8	-179.8	-57.2	-54.8	0	0	0	111.4	V95 F313 A314 R315 L336 L337	V95-I317 HydrophobicContact CG1-CB 3.6Å; V95-I317 HydrophobicContact CG1-CG1 3.93Å; V95-I317 HydrophobicContact CG1-CG2 3.74Å; F313-I317 HydrophobicContact CD1-CG1 4.43Å; F313-I317 HydrophobicContact CE1-CD1 4.44Å; F313-I317 HydrophobicContact CE1-CG1 3.94Å; F313-I317 HydrophobicContact CZ-CD1 4.19Å; F313-I317 HydrophobicContact CZ-CG1 4.18Å; F313-I317 PolarHBondContact O-N 2.88Å; A314-I317 PolarHBondContact O-N 3.24Å; R315-I317 VanDerWaalsContact C-N 3.32Å; R315-I317 PolarHBondContact O-N 3.21Å; I317-L336 HydrophobicContact CD1-CD1 3.94Å; I317-L336 PolarHBondContact O-N 2.99Å; I317-L337 VanDerWaalsContact O-CB 3.26Å; I317-L337 WeakPolarHBondContact O-CB 3.44Å; I317-L337 PolarHBondContact O-N 2.78Å
318	N	92.2	Very high	86.8	Confident	31 Å²	31	47.4 Å²	47.4	17%	0.166	28%	0.277	C	S	.	.			trans	-145.2	95.9	-175.4	179.7	15.1	0	0	0	110.8	A314 Q320 Q321 L337 Q338	A314-N318 CarbonylContact O-C 3.34Å; A314-N318 PolarHBondContact O-N 3.35Å; N318-Q320 PolarHBondContact O-N 2.72Å; N318-Q320 VanDerWaalsContact O-N 3.11Å; N318-Q320 PolarHBondContact OD1-N 2.69Å; N318-Q321 HydrophobicContact CB-CB 4.37Å; N318-Q321 VanDerWaalsContact O-CB 3.31Å; N318-Q321 WeakPolarHBondContact O-CB 3.45Å; N318-Q321 PolarHBondContact O-N 2.85Å; N318-Q321 VanDerWaalsContact O-N 3.1Å; N318-L337 HydrophobicContact CB-CB 4.3Å; N318-L337 HydrophobicContact CB-CD2 4.09Å; N318-Q338 PolarHBondContact OD1-NE2 3.3Å
319	S	90.4	Very high	85.4	Confident	19 Å²	19	51 Å²	51	13%	0.133	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.7	-178.2	63.9	0	0	0	0	114.7	R315 T333 Q338	R315-S319 PolarHBondContact O-N 3.42Å; S319-T333 WeakPolarHBondContact CB-O 3.49Å; S319-T333 PolarHBondContact OG-O 2.99Å; S319-Q338 VanDerWaalsContact N-OE1 3.12Å; S319-Q338 PolarHBondContact OG-OE1 2.81Å
320	Q	87.4	Confident	83.6	Confident	132 Å²	132	60.6 Å²	60.6	62%	0.617	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	16.4	176.3	-67.2	-178.4	-33.2	0	0	112.8	N318 S322 F332	N318-Q320 PolarHBondContact O-N 2.72Å; N318-Q320 VanDerWaalsContact O-N 3.11Å; N318-Q320 PolarHBondContact OD1-N 2.69Å; Q320-S322 PolarHBondContact O-N 3Å; Q320-F332 HydrophobicContact CG-CE2 3.5Å; Q320-F332 HydrophobicContact CG-CZ 3.75Å
321	Q	85.5	Confident	82.8	Confident	35 Å²	35	67.5 Å²	67.5	16%	0.164	37%	0.37	C	S	.	.			trans	-65.1	131	178.8	179.7	141.8	-23.1	0	0	111.8	L172 N318 L324	L172-Q321 HydrophobicContact CD2-CG 4.02Å; N318-Q321 HydrophobicContact CB-CB 4.37Å; N318-Q321 VanDerWaalsContact O-CB 3.31Å; N318-Q321 WeakPolarHBondContact O-CB 3.45Å; N318-Q321 PolarHBondContact O-N 2.85Å; N318-Q321 VanDerWaalsContact O-N 3.1Å; Q321-L324 HydrophobicContact CB-CD1 3.78Å; Q321-L324 HydrophobicContact CB-CG 4.12Å; Q321-L324 WeakPolarHBondContact O-CD1 3.37Å; Q321-L324 WeakPolarHBondContact O-CG 3.33Å; Q321-L324 PolarHBondContact O-N 3.35Å
322	S	82.6	Confident	82.1	Confident	110 Å²	110	72.6 Å²	72.6	77%	0.769	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	139.2	174.2	-47.5	0	0	0	0	111.6	Q320	Q320-S322 PolarHBondContact O-N 3Å
323	G	80.9	Confident	81.8	Confident	62 Å²	62	72.3 Å²	72.3	64%	0.639	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	9	179.2	0	0	0	0	0	114.7
324	L	83.4	Confident	81.6	Confident	33 Å²	33	78.3 Å²	78.3	17%	0.173	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-71.7	137.6	168.6	-77.1	170.6	0	0	0	110.7	L172 A311 A314 R315 Q321	L172-L324 HydrophobicContact CD1-CD2 3.53Å; L172-L324 HydrophobicContact CD1-CG 4.18Å; A311-L324 HydrophobicContact CB-CD2 4.05Å; A311-L324 WeakPolarHBondContact O-CD2 3.5Å; A314-L324 HydrophobicContact CB-CD2 3.88Å; R315-L324 HydrophobicContact CG-CD1 3.71Å; R315-L324 HydrophobicContact CG-CD2 3.91Å; R315-L324 HydrophobicContact CG-CG 4.41Å; Q321-L324 HydrophobicContact CB-CD1 3.78Å; Q321-L324 HydrophobicContact CB-CG 4.12Å; Q321-L324 WeakPolarHBondContact O-CD1 3.37Å; Q321-L324 WeakPolarHBondContact O-CG 3.33Å; Q321-L324 PolarHBondContact O-N 3.35Å
325	P	81.6	Confident	81.6	Confident	52 Å²	52	78.2 Å²	78.2	34%	0.338	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-62	150	171.3	18.1	-21.1	0	0	0	110.6	A311 R315	A311-P325 HydrophobicContact CB-CG 3.77Å; R315-P325 PolarHBondContact NH2-O 3.36Å
326	P	75.7	Confident	81.7	Confident	126 Å²	126	80.6 Å²	80.6	82%	0.818	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-63.4	141.4	175.7	27.2	-33.1	0	0	0	110.3
327	V	71	Confident	81.7	Confident	54 Å²	54	84.3 Å²	84.3	33%	0.327	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-87.5	131	171.9	-177.1	0	0	0	0	107.6	W285 R315 D329	W285-V327 HydrophobicContact CH2-CG1 4.28Å; R315-V327 VanDerWaalsContact NE-CG2 3.31Å; V327-D329 PolarHBondContact O-N 2.84Å
328	Q	62.2	Low	81.7	Confident	187 Å²	187	84.3 Å²	84.3	87%	0.874	45%	0.445	S	S	*	.	S	Bend	trans	-64.2	124.9	168.8	-72.3	179.5	-14	0	0	107.4
329	D	60.7	Low	81.8	Confident	140 Å²	140	84.3 Å²	84.3	75%	0.749	44%	0.443	S	S	*	.	S	Bend	trans	81.2	104.6	-163.1	-56.5	-27.9	0	0	0	114.5	V327 K331	V327-D329 PolarHBondContact O-N 2.84Å; D329-K331 PolarHBondContact O-N 3.36Å
330	H	55.3	Low	82.1	Confident	201 Å²	201	87.1 Å²	87.1	93%	0.931	46%	0.456	S	S	*	.			trans	-60.2	18	-177	-65.4	-73.7	0	0	0	116.4	F332	H330-F332 PolarHBondContact O-N 3.37Å; H330-F332 VanDerWaalsContact O-N 3.13Å
331	K	74.1	Confident	82.3	Confident	151 Å²	151	83.3 Å²	83.3	66%	0.657	45%	0.447	S	S	*	.			trans	-78	104.3	177.2	-165.4	172.4	-177.6	178.1	0	109.4	D329 T333	D329-K331 PolarHBondContact O-N 3.36Å; K331-T333 PolarHBondContact O-N 3.27Å
332	F	78.7	Confident	82.6	Confident	111 Å²	111	83.8 Å²	83.8	49%	0.487	46%	0.462	S	S	.	.			trans	-55.5	122.1	171.1	178.8	-103	0	0	0	110.7	Q320 H330 R334 Q338	Q320-F332 HydrophobicContact CG-CE2 3.5Å; Q320-F332 HydrophobicContact CG-CZ 3.75Å; H330-F332 PolarHBondContact O-N 3.37Å; H330-F332 VanDerWaalsContact O-N 3.13Å; F332-R334 HydrophobicContact CD1-CG 4.43Å; F332-R334 HydrophobicContact CE1-CG 4.03Å; F332-Q338 HydrophobicContact CE1-CG 4.43Å; F332-Q338 HydrophobicContact CZ-CG 3.86Å
333	T	85.9	Confident	83	Confident	18 Å²	18	85.5 Å²	85.5	11%	0.11	46%	0.455	C	S	.	.			trans	-102.1	144.3	177.8	54.6	0	0	0	0	110.6	M282 S319 K331	M282-T333 VanDerWaalsContact CE-CB 3.45Å; M282-T333 WeakPolarHBondContact CE-OG1 3.18Å; S319-T333 WeakPolarHBondContact CB-O 3.49Å; S319-T333 PolarHBondContact OG-O 2.99Å; K331-T333 PolarHBondContact O-N 3.27Å
334	R	90.8	Very high	83.5	Confident	133 Å²	133	90.5 Å²	90.5	50%	0.502	46%	0.462	S	S	.	.			trans	-97.5	101.4	-177.9	-65.6	-175	-62	170.1	1.2	111.7	D278 F332 Q338 R339	D278-R334 PolarHBondContact OD2-N 3.36Å; F332-R334 HydrophobicContact CD1-CG 4.43Å; F332-R334 HydrophobicContact CE1-CG 4.03Å; R334-Q338 HydrophobicContact CB-CB 4.21Å; R334-Q338 HydrophobicContact CG-CB 4.48Å; R334-R339 PolarHBondContact O-NE 3.13Å
335	G	93.2	Very high	84	Confident	0 Å²	0	89 Å²	89	0%	0	45%	0.454	C	S	.	.			trans	-68.8	-177.2	169.2	0	0	0	0	0	113	L316 L337 Q338 R339	L316-G335 CarbonylContact O-C 3.56Å; L316-G335 VanDerWaalsContact O-CA 3.32Å; L316-G335 WeakPolarHBondContact O-CA 3.25Å; G335-L337 PolarHBondContact O-N 3.46Å; G335-Q338 PolarHBondContact O-N 2.88Å; G335-R339 WeakPolarHBondContact O-CG 3.04Å; G335-R339 PolarHBondContact O-N 2.64Å
336	L	95.4	Very high	84.6	Confident	61 Å²	61	92.7 Å²	92.7	32%	0.319	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-45.1	-176.4	-66.1	176.7	0	0	0	112.4	L279 L316 I317 Q338 R339 L340	L279-L336 HydrophobicContact CD1-CD2 4Å; L279-L336 HydrophobicContact CD2-CD2 3.95Å; L279-L336 HydrophobicContact CD2-CG 4.3Å; L316-L336 PolarHBondContact O-N 3.44Å; I317-L336 HydrophobicContact CD1-CD1 3.94Å; I317-L336 PolarHBondContact O-N 2.99Å; L336-Q338 VanDerWaalsContact C-N 3.33Å; L336-Q338 PolarHBondContact O-N 2.9Å; L336-R339 WeakPolarHBondContact O-CB 3.36Å; L336-R339 PolarHBondContact O-N 3.02Å; L336-R339 VanDerWaalsContact O-N 3.14Å; L336-L340 WeakPolarHBondContact O-CG 3.33Å; L336-L340 PolarHBondContact O-N 3.45Å; L336-L340 VanDerWaalsContact O-N 3.16Å
337	L	94.6	Very high	85.5	Confident	82 Å²	82	92.6 Å²	92.6	43%	0.429	45%	0.448	S	S	.	.	H	α-helix	trans	-64.5	-39.4	-178.6	-170.3	64.9	0	0	0	111.7	I317 N318 G335 R339 L340 A341	I317-L337 VanDerWaalsContact O-CB 3.26Å; I317-L337 WeakPolarHBondContact O-CB 3.44Å; I317-L337 PolarHBondContact O-N 2.78Å; N318-L337 HydrophobicContact CB-CB 4.3Å; N318-L337 HydrophobicContact CB-CD2 4.09Å; G335-L337 PolarHBondContact O-N 3.46Å; L337-R339 PolarHBondContact O-N 2.87Å; L337-L340 PolarHBondContact O-N 3.41Å; L337-L340 VanDerWaalsContact O-N 3.16Å; L337-A341 VanDerWaalsContact O-CB 3.29Å; L337-A341 WeakPolarHBondContact O-CB 3.46Å; L337-A341 PolarHBondContact O-N 3.05Å
338	Q	93.8	Very high	86.6	Confident	32 Å²	32	97.2 Å²	97.2	15%	0.15	46%	0.46	C	S	.	.	H	α-helix	trans	-63.6	-28.6	176.8	-72.8	64.8	37.2	0	0	112.4	N318 S319 F332 R334 G335 L336	N318-Q338 PolarHBondContact OD1-NE2 3.3Å; S319-Q338 VanDerWaalsContact N-OE1 3.12Å; S319-Q338 PolarHBondContact OG-OE1 2.81Å; F332-Q338 HydrophobicContact CE1-CG 4.43Å; F332-Q338 HydrophobicContact CZ-CG 3.86Å; R334-Q338 HydrophobicContact CB-CB 4.21Å; R334-Q338 HydrophobicContact CG-CB 4.48Å; G335-Q338 PolarHBondContact O-N 2.88Å; L336-Q338 VanDerWaalsContact C-N 3.33Å; L336-Q338 PolarHBondContact O-N 2.9Å
339	R	94.9	Very high	88.1	Confident	32 Å²	32	90.1 Å²	90.1	12%	0.121	44%	0.437	C	S	.	.	H	α-helix	trans	-78.9	-28.9	175.5	-66.8	173.4	-177.7	-124.8	-16	112.8	I262 D277 R334 G335 L336 L337 G345 R346	I262-R339 PolarHBondContact O-NH1 2.73Å; D277-R339 IonicContact OD1-CZ 3.89Å; D277-R339 VanDerWaalsContact OD1-CZ 3.25Å; D277-R339 IonicContact OD1-NH1 3.9Å; D277-R339 PolarHBondContact OD1-NH1 2.84Å; D277-R339 IonicContact OD1-NH2 2.82Å; D277-R339 PolarHBondContact OD1-NH2 3.48Å; D277-R339 IonicContact OD2-CZ 3.85Å; D277-R339 IonicContact OD2-NH1 2.65Å; D277-R339 PolarHBondContact OD2-NH1 3.48Å; D277-R339 VanDerWaalsContact OD2-NH1 3.09Å; D277-R339 IonicContact OD2-NH2 3.81Å; D277-R339 PolarHBondContact OD2-NH2 3.25Å; R334-R339 PolarHBondContact O-NE 3.13Å; G335-R339 WeakPolarHBondContact O-CG 3.04Å; G335-R339 PolarHBondContact O-N 2.64Å; L336-R339 WeakPolarHBondContact O-CB 3.36Å; L336-R339 PolarHBondContact O-N 3.02Å; L336-R339 VanDerWaalsContact O-N 3.14Å; L337-R339 PolarHBondContact O-N 2.87Å; R339-G345 VanDerWaalsContact O-CA 3.26Å; R339-G345 WeakPolarHBondContact O-CA 2.98Å; R339-R346 PolarHBondContact O-N 2.84Å
340	L	95.9	Very high	89.6	Confident	77 Å²	77	85.6 Å²	85.6	40%	0.403	42%	0.417	S	S	.	.	H	α-helix	trans	-86	-42.1	-179.5	-67	174.8	0	0	0	112.4	L336 L337 G345 R346 F347	L336-L340 WeakPolarHBondContact O-CG 3.33Å; L336-L340 PolarHBondContact O-N 3.45Å; L336-L340 VanDerWaalsContact O-N 3.16Å; L337-L340 PolarHBondContact O-N 3.41Å; L337-L340 VanDerWaalsContact O-N 3.16Å; L340-G345 CarbonylContact O-C 3.26Å; L340-G345 WeakPolarHBondContact O-CA 3.46Å; L340-R346 HydrophobicContact CD2-CB 4.12Å; L340-R346 HydrophobicContact CD2-CG 4.15Å; L340-R346 PolarHBondContact O-N 2.95Å; L340-F347 HydrophobicContact CB-CE2 4.34Å; L340-F347 HydrophobicContact CD2-CE2 4.49Å
341	A	92.9	Very high	91.5	Very high	52 Å²	52	82 Å²	82	43%	0.43	40%	0.404	S	S	.	.	S	Bend	trans	-88.4	168	-171.5	0	0	0	0	0	113.8	L337 G345	L337-A341 VanDerWaalsContact O-CB 3.29Å; L337-A341 WeakPolarHBondContact O-CB 3.46Å; L337-A341 PolarHBondContact O-N 3.05Å; A341-G345 VanDerWaalsContact O-CA 3.25Å; A341-G345 WeakPolarHBondContact O-CA 3.49Å; A341-G345 PolarHBondContact O-N 3.22Å
342	G	91	Very high	92.4	Very high	46 Å²	46	82 Å²	82	47%	0.474	41%	0.41	S	S	.	.	S	Bend	trans	81.2	-177.7	174.3	0	0	0	0	0	114.7	H344 G345	G342-H344 VanDerWaalsContact C-N 3.35Å; G342-H344 PolarHBondContact O-N 3.01Å; G342-G345 PolarHBondContact O-N 2.91Å
343	K	91.9	Very high	93	Very high	146 Å²	146	78.5 Å²	78.5	64%	0.635	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-37.9	-175.9	-176.7	178.3	179.4	-178.9	0	112.7
344	H	91.6	Very high	93.3	Very high	166 Å²	166	85.1 Å²	85.1	77%	0.769	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	4.3	179.9	-58.7	-66.5	0	0	0	113.3	G342	G342-H344 VanDerWaalsContact C-N 3.35Å; G342-H344 PolarHBondContact O-N 3.01Å
345	G	93.5	Very high	93.3	Very high	2 Å²	2	90.7 Å²	90.7	2%	0.021	45%	0.453	C	S	.	.	S	Bend	trans	-74.5	168.4	176.9	0	0	0	0	0	112.7	R339 L340 A341 G342 F347 R348 G349	R339-G345 VanDerWaalsContact O-CA 3.26Å; R339-G345 WeakPolarHBondContact O-CA 2.98Å; L340-G345 CarbonylContact O-C 3.26Å; L340-G345 WeakPolarHBondContact O-CA 3.46Å; A341-G345 VanDerWaalsContact O-CA 3.25Å; A341-G345 WeakPolarHBondContact O-CA 3.49Å; A341-G345 PolarHBondContact O-N 3.22Å; G342-G345 PolarHBondContact O-N 2.91Å; G345-F347 PolarHBondContact O-N 3.05Å; G345-R348 PolarHBondContact O-N 3.22Å; G345-G349 WeakPolarHBondContact O-CA 3.43Å; G345-G349 PolarHBondContact O-N 3.45Å
346	R	94.8	Very high	93.4	Very high	129 Å²	129	94.7 Å²	94.7	49%	0.487	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-44	-174.5	-67.9	-67.9	177.8	-100	0.9	114.2	R339 L340 R348 S350 L351	R339-R346 PolarHBondContact O-N 2.84Å; L340-R346 HydrophobicContact CD2-CB 4.12Å; L340-R346 HydrophobicContact CD2-CG 4.15Å; L340-R346 PolarHBondContact O-N 2.95Å; R346-R348 PolarHBondContact O-N 2.63Å; R346-S350 WeakPolarHBondContact O-CA 3.41Å; R346-S350 WeakPolarHBondContact O-CB 3.37Å; R346-S350 PolarHBondContact O-N 3.43Å; R346-S350 VanDerWaalsContact O-N 3.1Å; R346-L351 PolarHBondContact O-N 2.91Å
347	F	94.6	Very high	93.2	Very high	124 Å²	124	98.3 Å²	98.3	54%	0.544	50%	0.498	S	S	.	.	I	π-helix	trans	-61.9	-48.2	-177.6	-70.5	-72.4	0	0	0	112.1	L340 G345 L351 L352	L340-F347 HydrophobicContact CB-CE2 4.34Å; L340-F347 HydrophobicContact CD2-CE2 4.49Å; G345-F347 PolarHBondContact O-N 3.05Å; F347-L351 HydrophobicContact CD1-CD1 3.98Å; F347-L351 HydrophobicContact CE1-CD1 4.33Å; F347-L352 WeakPolarHBondContact O-CB 3.41Å; F347-L352 VanDerWaalsContact O-CG 3.25Å; F347-L352 WeakPolarHBondContact O-CG 3.37Å; F347-L352 PolarHBondContact O-N 2.97Å
348	R	94	Very high	93.1	Very high	151 Å²	151	100.7 Å²	100.7	57%	0.57	51%	0.505	S	S	*	.	I	π-helix	trans	-86	-43.5	-175.3	-67.7	-179.5	65.7	-170.8	3.4	113.3	G345 R346 L352 G353	G345-R348 PolarHBondContact O-N 3.22Å; R346-R348 PolarHBondContact O-N 2.63Å; R348-L352 HydrophobicContact CG-CD1 4.49Å; R348-G353 PolarHBondContact O-N 3.1Å
349	G	92.1	Very high	93.2	Very high	38 Å²	38	104 Å²	104	39%	0.392	53%	0.527	S	S	.	.	I	π-helix	trans	-95.8	-1.4	-171.9	0	0	0	0	0	115.2	G345 G353	G345-G349 WeakPolarHBondContact O-CA 3.43Å; G345-G349 PolarHBondContact O-N 3.45Å; G349-G353 CarbonylContact C-O 3.59Å
350	S	93.3	Very high	93	Very high	46 Å²	46	105.5 Å²	105.5	32%	0.322	55%	0.546	S	S	.	.	I	π-helix	trans	-134.8	-40.3	178.6	-47.9	0	0	0	0	113.7	R346 G353	R346-S350 WeakPolarHBondContact O-CA 3.41Å; R346-S350 WeakPolarHBondContact O-CB 3.37Å; R346-S350 PolarHBondContact O-N 3.43Å; R346-S350 VanDerWaalsContact O-N 3.1Å; S350-G353 CarbonylContact C-O 3.52Å; S350-G353 WeakPolarHBondContact CA-O 3.35Å; S350-G353 PolarHBondContact N-O 2.77Å
351	L	94.2	Very high	93	Very high	126 Å²	126	113.6 Å²	113.6	66%	0.66	57%	0.572	S	S	*	*	I	π-helix	trans	-88.5	-54.3	-178.3	-64.3	176.6	0	0	0	112.2	R346 F347	R346-L351 PolarHBondContact O-N 2.91Å; F347-L351 HydrophobicContact CD1-CD1 3.98Å; F347-L351 HydrophobicContact CE1-CD1 4.33Å
352	L	94.5	Very high	93.1	Very high	151 Å²	151	115.7 Å²	115.7	79%	0.791	58%	0.579	S	S	*	*	I	π-helix	trans	-75	-34.9	-179.8	-69.4	171.7	0	0	0	112.9	F347 R348	F347-L352 WeakPolarHBondContact O-CB 3.41Å; F347-L352 VanDerWaalsContact O-CG 3.25Å; F347-L352 WeakPolarHBondContact O-CG 3.37Å; F347-L352 PolarHBondContact O-N 2.97Å; R348-L352 HydrophobicContact CG-CD1 4.49Å
353	G	90	Very high	93.3	Very high	37 Å²	37	119.7 Å²	119.7	38%	0.381	59%	0.594	S	S	.	*	S	Bend	trans	-138	131.9	176	0	0	0	0	0	109.8	R348 G349 S350	R348-G353 PolarHBondContact O-N 3.1Å; G349-G353 CarbonylContact C-O 3.59Å; S350-G353 CarbonylContact C-O 3.52Å; S350-G353 WeakPolarHBondContact CA-O 3.35Å; S350-G353 PolarHBondContact N-O 2.77Å
354	K	93.1	Very high	93.5	Very high	157 Å²	157	120.4 Å²	120.4	68%	0.683	60%	0.603	S	S	*	*			trans	-139.3	155.1	177.4	58.9	-175.4	167.7	-175.2	0	110.4	T356	K354-T356 HydrophobicContact CG-CG2 4.43Å; K354-T356 PolarHBondContact O-N 3.46Å
355	R	90.9	Very high	93.8	Very high	250 Å²	250	117.5 Å²	117.5	94%	0.943	60%	0.601	S	S	*	*			trans	-68.8	128.3	168.6	-68	-177.2	174.8	-131.1	0.6	108.3
356	T	93.6	Very high	93.9	Very high	83 Å²	83	123.6 Å²	123.6	51%	0.509	64%	0.641	S	S	.	*			trans	-108.3	150.2	176.5	54	0	0	0	0	109.8	K354 T359	K354-T356 HydrophobicContact CG-CG2 4.43Å; K354-T356 PolarHBondContact O-N 3.46Å; T356-T359 WeakPolarHBondContact OG1-CG2 3.47Å
357	N	92.6	Very high	94	Very high	138 Å²	138	121.1 Å²	121.1	74%	0.738	64%	0.637	S	S	*	*	S	Bend	trans	-79.8	173.4	171.6	-62.9	-25.6	0	0	0	109.9	T359	N357-T359 PolarHBondContact O-N 2.82Å
358	F	93.1	Very high	94	Very high	132 Å²	132	121 Å²	121	58%	0.579	65%	0.649	S	S	*	*	S	Bend	trans	57.8	45	178.7	-54.9	-82.2	0	0	0	113.7	T386	F358-T386 WeakPolarHBondContact CE1-OG1 3.46Å
359	T	93.9	Very high	94.1	Very high	100 Å²	100	120.7 Å²	120.7	61%	0.613	66%	0.658	S	S	*	*			trans	-126.5	149.5	174.5	59.3	0	0	0	0	110.3	T356 N357	T356-T359 WeakPolarHBondContact OG1-CG2 3.47Å; N357-T359 PolarHBondContact O-N 2.82Å
360	A	92.5	Very high	94.1	Very high	64 Å²	64	122.1 Å²	122.1	53%	0.529	66%	0.656	S	S	.	*			trans	-135.6	155.7	174.8	0	0	0	0	0	110.6	L385	A360-L385 HydrophobicContact CB-CD1 3.85Å; A360-L385 HydrophobicContact CB-CG 4.47Å
361	R	94.7	Very high	94.1	Very high	248 Å²	248	127.4 Å²	127.4	94%	0.936	67%	0.669	S	S	*	*			trans	-137.5	128.3	176.7	-171.4	178.5	-170.7	-179.6	2.8	109.5
362	T	94.5	Very high	94.1	Very high	96 Å²	96	130.1 Å²	130.1	59%	0.589	68%	0.682	S	S	*	*			trans	-141.4	166.8	177.4	-171.6	0	0	0	0	110.5
363	V	96.7	Very high	94	Very high	130 Å²	130	128.1 Å²	128.1	79%	0.788	67%	0.672	S	S	*	*			trans	-70.7	139.9	171.4	-179.4	0	0	0	0	109.1
364	I	96.1	Very high	94.1	Very high	161 Å²	161	130.2 Å²	130.2	83%	0.826	67%	0.672	S	S	*	*			trans	-86.7	141.9	177.2	59.7	172.9	0	0	0	110.9
365	S	96.2	Very high	94.1	Very high	104 Å²	104	128 Å²	128	73%	0.727	67%	0.671	S	S	*	*			trans	-135.1	141.9	173.4	54.6	0	0	0	0	109.7
366	P	96.5	Very high	94.2	Very high	131 Å²	131	119.7 Å²	119.7	85%	0.851	65%	0.65	S	S	*	*			trans	-72.3	141.9	179.6	30.6	-34.4	0	0	0	111.4
367	D	96.2	Very high	94.2	Very high	76 Å²	76	118.5 Å²	118.5	41%	0.406	64%	0.641	S	S	.	*			trans	-140.2	106.1	168.9	-172.3	-11.3	0	0	0	109.3	N369 M370	D367-N369 VanDerWaalsContact C-N 3.26Å; D367-N369 PolarHBondContact O-N 3.37Å; D367-N369 WeakPolarHBondContact OD1-CB 3.32Å; D367-N369 PolarHBondContact OD1-N 3.44Å; D367-N369 PolarHBondContact OD1-ND2 3.11Å; D367-N369 VanDerWaalsContact OD1-ND2 3.16Å; D367-M370 HydrophobicContact CB-CG 4.27Å
368	P	95.5	Very high	94.3	Very high	122 Å²	122	114.9 Å²	114.9	79%	0.792	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-8.3	-177	32.8	-36	0	0	0	113.7	M370	P368-M370 VanDerWaalsContact C-N 3.31Å
369	N	96.5	Very high	94.3	Very high	144 Å²	144	112.1 Å²	112.1	77%	0.77	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-16.5	-179.9	-57.7	-59.1	0	0	0	112.6	D367	D367-N369 VanDerWaalsContact C-N 3.26Å; D367-N369 PolarHBondContact O-N 3.37Å; D367-N369 WeakPolarHBondContact OD1-CB 3.32Å; D367-N369 PolarHBondContact OD1-N 3.44Å; D367-N369 PolarHBondContact OD1-ND2 3.11Å; D367-N369 VanDerWaalsContact OD1-ND2 3.16Å
370	M	91.1	Very high	94.4	Very high	69 Å²	69	117.2 Å²	117.2	34%	0.34	63%	0.626	S	S	.	*	S	Bend	trans	-82.5	150	180	-65.3	-56.6	-64.9	0	0	111.3	D367 P368 E374 C376	D367-M370 HydrophobicContact CB-CG 4.27Å; P368-M370 VanDerWaalsContact C-N 3.31Å; M370-E374 HydrophobicContact CE-CB 3.5Å; M370-E374 VanDerWaalsContact CE-CB 3.5Å; M370-E374 HydrophobicContact CE-CG 4.24Å; M370-E374 VanDerWaalsContact CE-OE2 3.28Å; M370-E374 WeakPolarHBondContact CE-OE2 3.47Å; M370-C376 WeakPolarHBondContact CG-SG 3.34Å
371	R	93.2	Very high	94.4	Very high	156 Å²	156	115.6 Å²	115.6	59%	0.589	61%	0.61	S	S	*	*			trans	-72.5	160.4	173.7	-58.8	170.4	51.4	96.9	0.2	110.8	D373 E374	R371-D373 WeakPolarHBondContact CB-OD1 3.46Å; R371-D373 IonicContact CZ-OD1 2.97Å; R371-D373 IonicContact CZ-OD2 3.3Å; R371-D373 IonicContact NE-OD1 2.81Å; R371-D373 PolarHBondContact NE-OD1 3.2Å; R371-D373 IonicContact NE-OD2 3.17Å; R371-D373 IonicContact NH2-OD1 2.67Å; R371-D373 IonicContact NH2-OD2 2.99Å; R371-D373 PolarHBondContact NH2-OD2 2.84Å; R371-D373 PolarHBondContact O-N 3.1Å; R371-D373 VanDerWaalsContact O-N 3.17Å; R371-E374 HydrophobicContact CB-CB 4.49Å; R371-E374 HydrophobicContact CB-CG 4.06Å; R371-E374 WeakPolarHBondContact CB-OE2 3.49Å; R371-E374 WeakPolarHBondContact CG-OE2 3.19Å; R371-E374 PolarHBondContact N-OE2 3.07Å; R371-E374 VanDerWaalsContact N-OE2 3.17Å; R371-E374 PolarHBondContact O-N 3.38Å; R371-E374 VanDerWaalsContact O-N 3.11Å
372	I	94	Very high	94.4	Very high	184 Å²	184	103.9 Å²	103.9	94%	0.944	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-19.6	179.7	62.7	171.8	0	0	0	113.9
373	D	93.4	Very high	94.4	Very high	108 Å²	108	102.3 Å²	102.3	58%	0.578	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	6.7	179.6	52.7	-11.8	0	0	0	112.9	R371	R371-D373 WeakPolarHBondContact CB-OD1 3.46Å; R371-D373 IonicContact CZ-OD1 2.97Å; R371-D373 IonicContact CZ-OD2 3.3Å; R371-D373 IonicContact NE-OD1 2.81Å; R371-D373 PolarHBondContact NE-OD1 3.2Å; R371-D373 IonicContact NE-OD2 3.17Å; R371-D373 IonicContact NH2-OD1 2.67Å; R371-D373 IonicContact NH2-OD2 2.99Å; R371-D373 PolarHBondContact NH2-OD2 2.84Å; R371-D373 PolarHBondContact O-N 3.1Å; R371-D373 VanDerWaalsContact O-N 3.17Å
374	E	92	Very high	94.2	Very high	82 Å²	82	102.3 Å²	102.3	38%	0.383	55%	0.547	S	S	.	.			trans	-120.2	153.4	-175.9	-64.9	175.4	152.9	0	0	112.7	M370 R371	M370-E374 HydrophobicContact CE-CB 3.5Å; M370-E374 VanDerWaalsContact CE-CB 3.5Å; M370-E374 HydrophobicContact CE-CG 4.24Å; M370-E374 VanDerWaalsContact CE-OE2 3.28Å; M370-E374 WeakPolarHBondContact CE-OE2 3.47Å; R371-E374 HydrophobicContact CB-CB 4.49Å; R371-E374 HydrophobicContact CB-CG 4.06Å; R371-E374 WeakPolarHBondContact CB-OE2 3.49Å; R371-E374 WeakPolarHBondContact CG-OE2 3.19Å; R371-E374 PolarHBondContact N-OE2 3.07Å; R371-E374 VanDerWaalsContact N-OE2 3.17Å; R371-E374 PolarHBondContact O-N 3.38Å; R371-E374 VanDerWaalsContact O-N 3.11Å
375	V	93	Very high	94.2	Very high	109 Å²	109	96.1 Å²	96.1	66%	0.661	52%	0.515	S	S	*	.			trans	-138.6	129.7	174.5	62.7	0	0	0	0	110.8	I377	V375-I377 HydrophobicContact CG1-CG1 4.46Å; V375-I377 PolarHBondContact O-N 3.04Å
376	C	92.4	Very high	94.1	Very high	76 Å²	76	92 Å²	92	51%	0.514	49%	0.486	S	S	.	.			trans	-77.2	119	175.5	-70.5	0	0	0	0	110.8	M370	M370-C376 WeakPolarHBondContact CG-SG 3.34Å
377	I	93.4	Very high	94	Very high	59 Å²	59	92 Å²	92	30%	0.303	47%	0.47	S	S	.	.			trans	-105.2	128.6	175.5	-63	170.2	0	0	0	108.8	V375 V379 C381 A382 L464 I470	V375-I377 HydrophobicContact CG1-CG1 4.46Å; V375-I377 PolarHBondContact O-N 3.04Å; I377-V379 PolarHBondContact O-N 3.13Å; I377-C381 HydrophobicContact CG2-CB 3.82Å; I377-A382 HydrophobicContact CG2-CB 4.45Å; I377-L464 HydrophobicContact CD1-CD1 4.24Å; I377-L464 HydrophobicContact CD1-CD2 3.59Å; I377-I470 HydrophobicContact CD1-CD1 3.94Å
378	P	94.9	Very high	94	Very high	61 Å²	61	92 Å²	92	40%	0.396	47%	0.474	S	S	.	.			trans	-58.4	137.6	175.8	-24.6	33.6	0	0	0	111.8	R380 C381 A382	P378-R380 PolarHBondContact O-N 3.33Å; P378-C381 WeakPolarHBondContact O-CA 3.26Å; P378-C381 WeakPolarHBondContact O-CB 3.47Å; P378-C381 PolarHBondContact O-N 2.84Å; P378-A382 PolarHBondContact O-N 2.85Å
379	V	94.4	Very high	93.9	Very high	74 Å²	74	87.9 Å²	87.9	45%	0.448	44%	0.444	S	S	.	.	H	α-helix	trans	-52.4	-35.7	179.8	176.1	0	0	0	0	112.2	I377 C381 A382 K383 Y410	I377-V379 PolarHBondContact O-N 3.13Å; V379-C381 VanDerWaalsContact C-N 3.31Å; V379-C381 PolarHBondContact O-N 3.49Å; V379-A382 PolarHBondContact O-N 2.85Å; V379-K383 HydrophobicContact CG1-CD 4.27Å; V379-K383 HydrophobicContact CG1-CG 4.34Å; V379-K383 WeakPolarHBondContact O-CG 3.46Å; V379-K383 PolarHBondContact O-N 3.35Å; V379-Y410 HydrophobicContact CG1-CD1 4.43Å; V379-Y410 HydrophobicContact CG1-CG 4.07Å
380	R	94.5	Very high	93.9	Very high	208 Å²	208	89.1 Å²	89.1	79%	0.785	44%	0.438	S	S	*	.	H	α-helix	trans	-61.2	-38.1	176.1	-172	176.9	-178.8	179.2	1.5	112.7	P378	P378-R380 PolarHBondContact O-N 3.33Å
381	C	93.9	Very high	94.1	Very high	29 Å²	29	86 Å²	86	20%	0.196	42%	0.422	C	S	.	.	H	α-helix	trans	-73.1	-42.3	174.3	-65.7	0	0	0	0	110.8	I377 P378 V379 K383 L384 L385	I377-C381 HydrophobicContact CG2-CB 3.82Å; P378-C381 WeakPolarHBondContact O-CA 3.26Å; P378-C381 WeakPolarHBondContact O-CB 3.47Å; P378-C381 PolarHBondContact O-N 2.84Å; V379-C381 VanDerWaalsContact C-N 3.31Å; V379-C381 PolarHBondContact O-N 3.49Å; C381-K383 VanDerWaalsContact C-N 3.29Å; C381-K383 PolarHBondContact O-N 2.91Å; C381-L384 PolarHBondContact O-N 2.88Å; C381-L384 VanDerWaalsContact O-N 3.07Å; C381-L385 PolarHBondContact O-N 2.78Å
382	A	93.9	Very high	94.2	Very high	3 Å²	3	80.4 Å²	80.4	3%	0.025	41%	0.41	C	S	.	.	H	α-helix	trans	-62	-32.9	-179.6	0	0	0	0	0	113.7	I377 P378 V379 Y410 H463 L464	I377-A382 HydrophobicContact CG2-CB 4.45Å; P378-A382 PolarHBondContact O-N 2.85Å; V379-A382 PolarHBondContact O-N 2.85Å; A382-Y410 HydrophobicContact CB-CD2 4.45Å; A382-Y410 HydrophobicContact CB-CE2 4Å; A382-H463 WeakPolarHBondContact O-CB 3.07Å; A382-L464 HydrophobicContact CB-CB 4.19Å; A382-L464 PolarHBondContact O-N 2.97Å
383	K	94.3	Very high	94.2	Very high	63 Å²	63	78.1 Å²	78.1	27%	0.274	40%	0.4	S	S	.	.	H	α-helix	trans	-70.1	-29.5	173.6	-71.5	-179	179.8	-179.3	0	113.6	V379 C381 N408 H463	V379-K383 HydrophobicContact CG1-CD 4.27Å; V379-K383 HydrophobicContact CG1-CG 4.34Å; V379-K383 WeakPolarHBondContact O-CG 3.46Å; V379-K383 PolarHBondContact O-N 3.35Å; C381-K383 VanDerWaalsContact C-N 3.29Å; C381-K383 PolarHBondContact O-N 2.91Å; K383-N408 WeakPolarHBondContact CE-O 3.44Å; K383-N408 PolarHBondContact NZ-O 3.09Å; K383-H463 PolarHBondContact O-CD2 3.35Å; K383-H463 PolarHBondContact O-NE2 3.16Å
384	L	93.8	Very high	94.3	Very high	129 Å²	129	79.8 Å²	79.8	68%	0.675	41%	0.414	S	S	*	.	H	α-helix	trans	-91.6	-36	-177.8	-67.4	174.1	0	0	0	113	C381 T386	C381-L384 PolarHBondContact O-N 2.88Å; C381-L384 VanDerWaalsContact O-N 3.07Å; L384-T386 PolarHBondContact O-N 3.2Å
385	L	94.4	Very high	94.4	Very high	32 Å²	32	77 Å²	77	17%	0.168	40%	0.401	C	S	.	.	S	Bend	trans	-81.8	101.9	175.9	-65.4	177.4	0	0	0	108.9	A360 C381 L464	A360-L385 HydrophobicContact CB-CD1 3.85Å; A360-L385 HydrophobicContact CB-CG 4.47Å; C381-L385 PolarHBondContact O-N 2.78Å; L385-L464 HydrophobicContact CB-CD1 4.14Å; L385-L464 HydrophobicContact CD1-CD1 4.41Å; L385-L464 WeakPolarHBondContact O-CB 3.39Å; L385-L464 PolarHBondContact O-N 3.25Å
386	T	94.4	Very high	94.5	Very high	17 Å²	17	73.4 Å²	73.4	10%	0.104	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	152.9	179.2	58.4	0	0	0	0	112.4	F358 L384 M414 E461 R462	F358-T386 WeakPolarHBondContact CE1-OG1 3.46Å; L384-T386 PolarHBondContact O-N 3.2Å; T386-M414 HydrophobicContact CG2-CB 3.7Å; T386-E461 HydrophobicContact CG2-CB 4.34Å; T386-E461 PolarHBondContact OG1-OE2 3.4Å; T386-R462 CarbonylContact C-O 3.56Å; T386-R462 WeakPolarHBondContact CA-O 3.5Å; T386-R462 WeakPolarHBondContact CB-O 3.48Å
387	Y	94.8	Very high	94.6	Very high	131 Å²	131	75.4 Å²	75.4	51%	0.514	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.2	170.7	-178.5	-101.5	0	0	0	109.6	E389 V460 E461 R462	Y387-E389 HydrophobicContact CD1-CB 4.03Å; Y387-E389 HydrophobicContact CE1-CB 4.2Å; Y387-E389 HydrophobicContact CE1-CG 4.42Å; Y387-E389 PolarHBondContact O-N 3.39Å; Y387-V460 VanDerWaalsContact O-O 3.11Å; Y387-E461 WeakPolarHBondContact O-CA 3.26Å; Y387-R462 PolarHBondContact N-O 2.91Å; Y387-R462 PolarHBondContact O-N 2.87Å; Y387-R462 VanDerWaalsContact O-N 3.13Å
388	P	95.3	Very high	94.7	Very high	76 Å²	76	77 Å²	77	49%	0.494	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	89.4	179.1	31.2	-33.5	0	0	0	110.2	I459 E461	P388-I459 HydrophobicContact CB-CG2 3.63Å; P388-E461 HydrophobicContact CB-CG 4.49Å
389	E	95.1	Very high	94.7	Very high	36 Å²	36	74.1 Å²	74.1	17%	0.168	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	123	178.1	-163.7	161.9	148.2	0	0	110.9	Y387 N395 L399 V460 R462	Y387-E389 HydrophobicContact CD1-CB 4.03Å; Y387-E389 HydrophobicContact CE1-CB 4.2Å; Y387-E389 HydrophobicContact CE1-CG 4.42Å; Y387-E389 PolarHBondContact O-N 3.39Å; E389-N395 PolarHBondContact OE1-ND2 2.85Å; E389-L399 HydrophobicContact CB-CD1 4.33Å; E389-L399 HydrophobicContact CB-CD2 4.14Å; E389-L399 HydrophobicContact CG-CD1 4.17Å; E389-L399 HydrophobicContact CG-CD2 4.32Å; E389-V460 PolarHBondContact N-O 3.04Å; E389-V460 PolarHBondContact O-N 2.97Å; E389-R462 HydrophobicContact CB-CG 4.45Å; E389-R462 IonicContact OE2-CZ 3.81Å; E389-R462 IonicContact OE2-NE 2.7Å; E389-R462 PolarHBondContact OE2-NE 3.31Å; E389-R462 IonicContact OE2-NH2 2.77Å; E389-R462 PolarHBondContact OE2-NH2 3.08Å
390	R	95.9	Very high	94.7	Very high	170 Å²	170	74 Å²	74	64%	0.642	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	130.5	174.6	-178.1	175	-79.3	-152.3	-3	109.5	A392 N395 D458	R390-A392 PolarHBondContact O-N 2.84Å; R390-N395 PolarHBondContact O-ND2 3.32Å; R390-D458 WeakPolarHBondContact CA-O 3.13Å
391	V	95.8	Very high	94.7	Very high	2 Å²	2	66.5 Å²	66.5	1%	0.012	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-70.7	126.4	174.2	-175.2	0	0	0	0	109.1	L396 L399 L454 Q455 S456 G457 D458 V460	V391-L396 HydrophobicContact CG1-CB 4.3Å; V391-L396 HydrophobicContact CG1-CD1 3.37Å; V391-L396 HydrophobicContact CG1-CG 4.45Å; V391-L399 HydrophobicContact CB-CD1 4.29Å; V391-L399 HydrophobicContact CG2-CD1 3.72Å; V391-L454 HydrophobicContact CG1-CD2 4.49Å; V391-L454 HydrophobicContact CG1-CG 4.39Å; V391-L454 HydrophobicContact CG2-CD1 3.98Å; V391-L454 HydrophobicContact CG2-CD2 4.03Å; V391-L454 HydrophobicContact CG2-CG 3.97Å; V391-Q455 WeakPolarHBondContact CB-O 3.41Å; V391-Q455 WeakPolarHBondContact CG1-O 3.38Å; V391-S456 WeakPolarHBondContact O-CA 3.46Å; V391-G457 PolarHBondContact O-N 2.93Å; V391-D458 HydrophobicContact CB-CB 4.45Å; V391-D458 HydrophobicContact CG2-CB 4.04Å; V391-D458 WeakPolarHBondContact CG2-O 3.09Å; V391-D458 PolarHBondContact N-O 3.48Å; V391-V460 HydrophobicContact CG2-CG2 3.83Å
392	A	94.7	Very high	94.8	Very high	40 Å²	40	65.2 Å²	65.2	33%	0.331	33%	0.332	S	S	.	.			trans	-134.2	166.6	172.1	0	0	0	0	0	108.5	R390 V394 N395 L396	R390-A392 PolarHBondContact O-N 2.84Å; A392-V394 HydrophobicContact CB-CG2 4.19Å; A392-V394 PolarHBondContact O-N 3.4Å; A392-N395 PolarHBondContact N-OD1 3.37Å; A392-N395 PolarHBondContact O-N 2.86Å; A392-N395 VanDerWaalsContact O-N 3.1Å; A392-N395 PolarHBondContact O-OD1 3.02Å; A392-L396 PolarHBondContact O-N 2.81Å
393	D	94.5	Very high	94.9	Very high	136 Å²	136	65.1 Å²	65.1	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.4	-174.7	-55.1	-25.9	0	0	0	112.4	S456	D393-S456 PolarHBondContact OD1-OG 3.23Å
394	V	95	Very high	94.9	Very high	143 Å²	143	66 Å²	66	87%	0.867	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-33.4	179.6	-62.6	0	0	0	0	114.3	A392	A392-V394 HydrophobicContact CB-CG2 4.19Å; A392-V394 PolarHBondContact O-N 3.4Å
395	N	94.4	Very high	94.9	Very high	23 Å²	23	63 Å²	63	12%	0.123	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	0.2	-175.5	68.3	2.8	0	0	0	112.9	E389 R390 A392 N397 F398 L399	E389-N395 PolarHBondContact OE1-ND2 2.85Å; R390-N395 PolarHBondContact O-ND2 3.32Å; A392-N395 PolarHBondContact N-OD1 3.37Å; A392-N395 PolarHBondContact O-N 2.86Å; A392-N395 VanDerWaalsContact O-N 3.1Å; A392-N395 PolarHBondContact O-OD1 3.02Å; N395-N397 PolarHBondContact O-N 3.24Å; N395-F398 WeakPolarHBondContact O-CB 3.36Å; N395-F398 PolarHBondContact O-N 3.05Å; N395-F398 VanDerWaalsContact O-N 3.13Å; N395-L399 HydrophobicContact CB-CD1 4.45Å; N395-L399 HydrophobicContact CB-CG 4.43Å; N395-L399 PolarHBondContact O-N 3.35Å
396	L	94	Very high	94.8	Very high	33 Å²	33	61.4 Å²	61.4	17%	0.173	32%	0.315	C	S	.	.	H	α-helix	trans	-53	-50.8	-176.5	179.7	68.4	0	0	0	112.8	V391 A392 F398 L399 R400 L454	V391-L396 HydrophobicContact CG1-CB 4.3Å; V391-L396 HydrophobicContact CG1-CD1 3.37Å; V391-L396 HydrophobicContact CG1-CG 4.45Å; A392-L396 PolarHBondContact O-N 2.81Å; L396-F398 VanDerWaalsContact C-N 3.31Å; L396-F398 PolarHBondContact O-N 2.58Å; L396-L399 PolarHBondContact O-N 3.19Å; L396-R400 WeakPolarHBondContact O-CB 3.47Å; L396-R400 PolarHBondContact O-N 3.34Å; L396-L454 HydrophobicContact CD1-CD2 4.3Å; L396-L454 HydrophobicContact CD1-CG 4.31Å
397	N	94.7	Very high	94.8	Very high	119 Å²	119	61 Å²	61	64%	0.636	31%	0.312	S	S	*	.	H	α-helix	trans	-66.6	-36	-178.1	-68.7	-27	0	0	0	112	N395 R400 S401	N395-N397 PolarHBondContact O-N 3.24Å; N397-R400 PolarHBondContact OD1-NH1 2.89Å; N397-S401 PolarHBondContact O-N 2.57Å; N397-S401 VanDerWaalsContact O-N 3.15Å
398	F	95	Very high	94.7	Very high	92 Å²	92	60.3 Å²	60.3	40%	0.404	32%	0.317	S	S	.	.	H	α-helix	trans	-68.2	-49.3	177.1	176.2	-110.5	0	0	0	111.8	N395 L396 R400 S401 L402 L465	N395-F398 WeakPolarHBondContact O-CB 3.36Å; N395-F398 PolarHBondContact O-N 3.05Å; N395-F398 VanDerWaalsContact O-N 3.13Å; L396-F398 VanDerWaalsContact C-N 3.31Å; L396-F398 PolarHBondContact O-N 2.58Å; F398-R400 VanDerWaalsContact C-N 3.25Å; F398-R400 PolarHBondContact O-N 2.96Å; F398-S401 PolarHBondContact O-N 3.07Å; F398-S401 PolarHBondContact O-OG 2.77Å; F398-L402 HydrophobicContact CD1-CD1 4.38Å; F398-L402 HydrophobicContact CE1-CD1 3.77Å; F398-L402 HydrophobicContact CZ-CD1 3.89Å; F398-L402 HydrophobicContact CZ-CD2 4.44Å; F398-L402 HydrophobicContact CZ-CG 4.35Å; F398-L402 WeakPolarHBondContact O-CG 3.21Å; F398-L402 PolarHBondContact O-N 3.1Å; F398-L465 HydrophobicContact CE1-CD1 3.82Å; F398-L465 HydrophobicContact CZ-CD1 3.5Å; F398-L465 VanDerWaalsContact CZ-CD1 3.5Å
399	L	95.4	Very high	94.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-32.8	176.6	-66.3	178.9	0	0	0	111.7	E389 V391 N395 L396 S401 L402 V403 L454 V460	E389-L399 HydrophobicContact CB-CD1 4.33Å; E389-L399 HydrophobicContact CB-CD2 4.14Å; E389-L399 HydrophobicContact CG-CD1 4.17Å; E389-L399 HydrophobicContact CG-CD2 4.32Å; V391-L399 HydrophobicContact CB-CD1 4.29Å; V391-L399 HydrophobicContact CG2-CD1 3.72Å; N395-L399 HydrophobicContact CB-CD1 4.45Å; N395-L399 HydrophobicContact CB-CG 4.43Å; N395-L399 PolarHBondContact O-N 3.35Å; L396-L399 PolarHBondContact O-N 3.19Å; L399-S401 PolarHBondContact O-N 3.32Å; L399-L402 HydrophobicContact CD2-CD1 4.22Å; L399-L402 PolarHBondContact O-N 2.61Å; L399-V403 VanDerWaalsContact O-CG2 3.31Å; L399-V403 WeakPolarHBondContact O-CG2 3.19Å; L399-V403 PolarHBondContact O-N 3.4Å; L399-L454 HydrophobicContact CB-CD2 4.2Å; L399-V460 HydrophobicContact CB-CG2 4.24Å; L399-V460 HydrophobicContact CD1-CB 4.41Å; L399-V460 HydrophobicContact CD1-CG2 4.37Å; L399-V460 HydrophobicContact CD2-CB 4.35Å; L399-V460 HydrophobicContact CD2-CG1 4.49Å
400	R	95	Very high	94.5	Very high	73 Å²	73	63.1 Å²	63.1	28%	0.275	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-42.3	173.8	-172.7	179.1	-74.3	139	-0.2	111.9	L396 N397 F398 V403 L404 A451 L454	L396-R400 WeakPolarHBondContact O-CB 3.47Å; L396-R400 PolarHBondContact O-N 3.34Å; N397-R400 PolarHBondContact OD1-NH1 2.89Å; F398-R400 VanDerWaalsContact C-N 3.25Å; F398-R400 PolarHBondContact O-N 2.96Å; R400-V403 PolarHBondContact O-N 2.82Å; R400-L404 WeakPolarHBondContact O-CG 3.17Å; R400-L404 PolarHBondContact O-N 3.35Å; R400-L404 VanDerWaalsContact O-N 3.12Å; R400-A451 HydrophobicContact CG-CB 3.79Å; R400-A451 PolarHBondContact NE-O 2.76Å; R400-L454 HydrophobicContact CB-CD2 4.5Å
401	S	95.2	Very high	94.4	Very high	50 Å²	50	57.7 Å²	57.7	35%	0.35	31%	0.311	S	S	.	.	H	α-helix	trans	-64.9	-41.8	176.4	69.5	0	0	0	0	111.7	N397 F398 L399 V403 L404 D405	N397-S401 PolarHBondContact O-N 2.57Å; N397-S401 VanDerWaalsContact O-N 3.15Å; F398-S401 PolarHBondContact O-N 3.07Å; F398-S401 PolarHBondContact O-OG 2.77Å; L399-S401 PolarHBondContact O-N 3.32Å; S401-V403 VanDerWaalsContact C-N 3.3Å; S401-V403 PolarHBondContact O-N 3.05Å; S401-L404 WeakPolarHBondContact O-CA 3.49Å; S401-L404 WeakPolarHBondContact O-CB 3.38Å; S401-L404 PolarHBondContact O-N 3.24Å; S401-D405 PolarHBondContact O-N 2.89Å
402	L	95.3	Very high	94.4	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-34.2	177	-60.4	-175.7	0	0	0	113.4	F398 L399 L404 D405 G406 P411 G412 A413 R462 L465	F398-L402 HydrophobicContact CD1-CD1 4.38Å; F398-L402 HydrophobicContact CE1-CD1 3.77Å; F398-L402 HydrophobicContact CZ-CD1 3.89Å; F398-L402 HydrophobicContact CZ-CD2 4.44Å; F398-L402 HydrophobicContact CZ-CG 4.35Å; F398-L402 WeakPolarHBondContact O-CG 3.21Å; F398-L402 PolarHBondContact O-N 3.1Å; L399-L402 HydrophobicContact CD2-CD1 4.22Å; L399-L402 PolarHBondContact O-N 2.61Å; L402-L404 VanDerWaalsContact C-N 3.34Å; L402-D405 PolarHBondContact O-N 2.95Å; L402-G406 PolarHBondContact O-N 3.23Å; L402-P411 HydrophobicContact CD2-CB 3.71Å; L402-P411 HydrophobicContact CD2-CG 3.99Å; L402-G412 CarbonylContact O-C 3.54Å; L402-A413 HydrophobicContact CB-CB 4.47Å; L402-A413 PolarHBondContact O-N 3.03Å; L402-R462 HydrophobicContact CD1-CB 3.82Å; L402-R462 HydrophobicContact CD1-CG 4.45Å; L402-L465 HydrophobicContact CD1-CD1 4.3Å
403	V	95.1	Very high	94.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-68.7	-35.5	174.3	171.9	0	0	0	0	111.1	L399 R400 S401 G406 A413 V416 L441 V450 A451 V460	L399-V403 VanDerWaalsContact O-CG2 3.31Å; L399-V403 WeakPolarHBondContact O-CG2 3.19Å; L399-V403 PolarHBondContact O-N 3.4Å; R400-V403 PolarHBondContact O-N 2.82Å; S401-V403 VanDerWaalsContact C-N 3.3Å; S401-V403 PolarHBondContact O-N 3.05Å; V403-G406 PolarHBondContact O-N 3.48Å; V403-A413 HydrophobicContact CG2-CB 4.48Å; V403-V416 HydrophobicContact CG1-CG2 4.4Å; V403-V416 HydrophobicContact CG2-CG2 3.8Å; V403-L441 HydrophobicContact CB-CD1 4.44Å; V403-L441 HydrophobicContact CG1-CD1 4.07Å; V403-L441 HydrophobicContact CG1-CD2 4.21Å; V403-L441 HydrophobicContact CG2-CD1 4.32Å; V403-V450 HydrophobicContact CG1-CB 4.17Å; V403-V450 HydrophobicContact CG1-CG1 4.01Å; V403-A451 HydrophobicContact CB-CB 4.42Å; V403-A451 HydrophobicContact CG1-CB 4.01Å; V403-V460 HydrophobicContact CG2-CG1 3.86Å; V403-V460 HydrophobicContact CG2-CG2 4.12Å
404	L	94.7	Very high	94.4	Very high	82 Å²	82	50.8 Å²	50.8	43%	0.429	27%	0.268	S	S	.	.	H	α-helix	trans	-68.1	-36.9	174.3	-70	170	0	0	0	112.3	R400 S401 L402 G406 H447 E448 A451	R400-L404 WeakPolarHBondContact O-CG 3.17Å; R400-L404 PolarHBondContact O-N 3.35Å; R400-L404 VanDerWaalsContact O-N 3.12Å; S401-L404 WeakPolarHBondContact O-CA 3.49Å; S401-L404 WeakPolarHBondContact O-CB 3.38Å; S401-L404 PolarHBondContact O-N 3.24Å; L402-L404 VanDerWaalsContact C-N 3.34Å; L404-G406 VanDerWaalsContact C-N 3.27Å; L404-G406 PolarHBondContact O-N 3.32Å; L404-H447 PolarHBondContact O-ND1 3.28Å; L404-E448 HydrophobicContact CD2-CG 4.23Å; L404-A451 HydrophobicContact CD2-CB 3.64Å; L404-A451 HydrophobicContact CG-CB 3.76Å
405	D	93.8	Very high	94.4	Very high	65 Å²	65	45.9 Å²	45.9	35%	0.348	24%	0.235	S	C	.	.	H	α-helix	trans	-69.5	-26.9	177.2	-67.7	-37.3	0	0	0	112.6	S401 L402 N409 P411	S401-D405 PolarHBondContact O-N 2.89Å; L402-D405 PolarHBondContact O-N 2.95Å; D405-N409 HydrophobicContact CB-CB 4.33Å; D405-N409 WeakPolarHBondContact O-CB 3.24Å; D405-N409 PolarHBondContact O-ND2 3.33Å; D405-N409 VanDerWaalsContact O-ND2 3.08Å; D405-P411 WeakPolarHBondContact CB-O 3.31Å
406	G	93.2	Very high	94.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	-166.5	175.7	0	0	0	0	0	114.4	L402 V403 L404 G412 A413	L402-G406 PolarHBondContact O-N 3.23Å; V403-G406 PolarHBondContact O-N 3.48Å; L404-G406 VanDerWaalsContact C-N 3.27Å; L404-G406 PolarHBondContact O-N 3.32Å; G406-G412 VanDerWaalsContact O-CA 3.31Å; G406-G412 WeakPolarHBondContact O-CA 3.19Å; G406-A413 CarbonylContact C-O 3.57Å; G406-A413 VanDerWaalsContact C-O 3.24Å; G406-A413 PolarHBondContact O-N 3.48Å; G406-A413 VanDerWaalsContact O-N 3.09Å
407	P	94.1	Very high	94.5	Very high	8 Å²	8	44 Å²	44	5%	0.052	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-22.1	-171.8	28.1	-34	0	0	0	114.8	A413 M414 L441 H463	P407-A413 WeakPolarHBondContact CA-O 3.26Å; P407-M414 HydrophobicContact CB-CE 3.21Å; P407-M414 HydrophobicContact CB-SD 3.48Å; P407-M414 WeakPolarHBondContact CB-SD 3.45Å; P407-M414 HydrophobicContact CG-CE 3.93Å; P407-L441 WeakPolarHBondContact CD-O 3.36Å; P407-L441 WeakPolarHBondContact CG-O 3.42Å; P407-H463 PolarHBondContact O-CE1 3.42Å; P407-H463 PolarHBondContact O-NE2 2.69Å
408	N	92.7	Very high	94.3	Very high	117 Å²	117	41.5 Å²	41.5	63%	0.626	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-24.6	-174.3	-68.7	-32.8	0	0	0	112.4	K383	K383-N408 WeakPolarHBondContact CE-O 3.44Å; K383-N408 PolarHBondContact NZ-O 3.09Å
409	N	92.6	Very high	93.8	Very high	96 Å²	96	42.6 Å²	42.6	51%	0.513	21%	0.213	S	C	.	.	S	Bend	trans	-95.4	150.2	179.1	-62.2	-40.5	0	0	0	111.1	D405 P411 H463	D405-N409 HydrophobicContact CB-CB 4.33Å; D405-N409 WeakPolarHBondContact O-CB 3.24Å; D405-N409 PolarHBondContact O-ND2 3.33Å; D405-N409 VanDerWaalsContact O-ND2 3.08Å; N409-P411 CarbonylContact O-C 3.24Å; N409-H463 PolarHBondContact O-CE1 3.47Å; N409-H463 PolarHBondContact O-ND1 2.93Å
410	Y	93	Very high	93.3	Very high	74 Å²	74	44 Å²	44	29%	0.29	22%	0.221	S	C	.	.	S	Bend	trans	-120.8	128.2	173.2	176.8	-94.8	0	0	0	108.8	V379 A382 H463 L464 L465	V379-Y410 HydrophobicContact CG1-CD1 4.43Å; V379-Y410 HydrophobicContact CG1-CG 4.07Å; A382-Y410 HydrophobicContact CB-CD2 4.45Å; A382-Y410 HydrophobicContact CB-CE2 4Å; Y410-H463 HydrophobicContact CD2-CB 4.1Å; Y410-H463 HydrophobicContact CE2-CB 4.27Å; Y410-L464 VanDerWaalsContact CE2-O 3.23Å; Y410-L464 WeakPolarHBondContact CE2-O 3.26Å; Y410-L464 PolarHBondContact OH-O 3.07Å; Y410-L465 HydrophobicContact CE2-CD2 4.47Å
411	P	94.8	Very high	92.6	Very high	56 Å²	56	47.1 Å²	47.1	36%	0.364	23%	0.232	S	C	.	.	S	Bend	cis	-72	156.8	-3.2	34.2	-37.8	0	0	0	112.3	L402 D405 N409 L465	L402-P411 HydrophobicContact CD2-CB 3.71Å; L402-P411 HydrophobicContact CD2-CG 3.99Å; D405-P411 WeakPolarHBondContact CB-O 3.31Å; N409-P411 CarbonylContact O-C 3.24Å; P411-L465 HydrophobicContact CB-CD2 3.3Å
412	G	95	Very high	92	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.			trans	-171.6	-166.8	-174.6	0	0	0	0	0	112.6	L402 G406 H463	L402-G412 CarbonylContact O-C 3.54Å; G406-G412 VanDerWaalsContact O-CA 3.31Å; G406-G412 WeakPolarHBondContact O-CA 3.19Å; G412-H463 WeakPolarHBondContact CA-ND1 3.23Å; G412-H463 PolarHBondContact N-ND1 2.96Å; G412-H463 PolarHBondContact O-N 2.72Å
413	A	95.3	Very high	91.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	148.5	-179.9	0	0	0	0	0	113.7	L402 V403 G406 P407 L441 V460 R462	L402-A413 HydrophobicContact CB-CB 4.47Å; L402-A413 PolarHBondContact O-N 3.03Å; V403-A413 HydrophobicContact CG2-CB 4.48Å; G406-A413 CarbonylContact C-O 3.57Å; G406-A413 VanDerWaalsContact C-O 3.24Å; G406-A413 PolarHBondContact O-N 3.48Å; G406-A413 VanDerWaalsContact O-N 3.09Å; P407-A413 WeakPolarHBondContact CA-O 3.26Å; A413-L441 HydrophobicContact CB-CD1 3.93Å; A413-V460 HydrophobicContact CB-CG1 3.7Å; A413-R462 HydrophobicContact CB-CB 4.46Å
414	M	94.4	Very high	90.5	Very high	34 Å²	34	62.1 Å²	62.1	17%	0.167	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-43.4	-175.1	-158.2	81.1	-133.6	0	0	113.2	T386 P407 F440 L441 E461	T386-M414 HydrophobicContact CG2-CB 3.7Å; P407-M414 HydrophobicContact CB-CE 3.21Å; P407-M414 HydrophobicContact CB-SD 3.48Å; P407-M414 WeakPolarHBondContact CB-SD 3.45Å; P407-M414 HydrophobicContact CG-CE 3.93Å; M414-F440 HydrophobicContact CE-CD2 4.12Å; M414-F440 HydrophobicContact CE-CE2 3.03Å; M414-F440 HydrophobicContact CE-CZ 3.3Å; M414-F440 HydrophobicContact CG-CD2 4.44Å; M414-F440 HydrophobicContact CG-CE2 3.9Å; M414-F440 WeakPolarHBondContact O-CD2 3.43Å; M414-F440 HydrophobicContact SD-CE2 4.24Å; M414-L441 PolarHBondContact O-N 2.81Å; M414-E461 PolarHBondContact N-O 3.45Å
415	F	95.1	Very high	89.8	Confident	39 Å²	39	61.2 Å²	61.2	17%	0.171	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	151	-178	-59.2	-92.6	0	0	0	111.2	R438 R439 F440 E461	F415-R438 HydrophobicContact CB-CG 4.28Å; F415-R438 HydrophobicContact CD1-CG 4.06Å; F415-R438 HydrophobicContact CG-CG 4.44Å; F415-R439 VanDerWaalsContact CA-O 3.28Å; F415-R439 WeakPolarHBondContact CA-O 3.28Å; F415-F440 HydrophobicContact CD1-CB 4.03Å; F415-F440 AromaticContact CD1-CD2 3.72Å; F415-F440 HydrophobicContact CD1-CD2 3.72Å; F415-F440 HydrophobicContact CD1-CG 4.35Å; F415-F440 HydrophobicContact CE1-CB 3.83Å; F415-F440 AromaticContact CE1-CD2 3.21Å; F415-F440 HydrophobicContact CE1-CD2 3.21Å; F415-F440 AromaticContact CE1-CE2 3.93Å; F415-F440 HydrophobicContact CE1-CE2 3.93Å; F415-F440 AromaticContact CE1-CG 3.86Å; F415-F440 HydrophobicContact CE1-CG 3.86Å; F415-F440 HydrophobicContact CE2-CD2 4.13Å; F415-F440 HydrophobicContact CE2-CE2 4.19Å; F415-F440 HydrophobicContact CG-CD2 4.36Å; F415-F440 AromaticContact CZ-CD2 3.43Å; F415-F440 HydrophobicContact CZ-CD2 3.43Å; F415-F440 VanDerWaalsContact CZ-CD2 3.43Å; F415-F440 AromaticContact CZ-CE2 3.64Å; F415-F440 HydrophobicContact CZ-CE2 3.64Å; F415-F440 HydrophobicContact CZ-CG 4.4Å; F415-E461 HydrophobicContact CB-CB 4.03Å; F415-E461 HydrophobicContact CB-CG 4.19Å; F415-E461 WeakPolarHBondContact CD2-OE2 3.39Å; F415-E461 PolarHBondContact O-N 3.42Å
416	V	94.9	Very high	88.9	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.4	166.2	-178	0	0	0	0	108.3	V403 Y418 R439 L441 V450 L454 I459 V460	V403-V416 HydrophobicContact CG1-CG2 4.4Å; V403-V416 HydrophobicContact CG2-CG2 3.8Å; V416-Y418 HydrophobicContact CG1-CD1 4.3Å; V416-R439 PolarHBondContact N-O 3.42Å; V416-R439 PolarHBondContact O-N 3.02Å; V416-L441 HydrophobicContact CG2-CD1 3.91Å; V416-L441 HydrophobicContact CG2-CD2 4.17Å; V416-L441 HydrophobicContact CG2-CG 4.25Å; V416-V450 HydrophobicContact CB-CG1 3.84Å; V416-V450 HydrophobicContact CG1-CG1 3.91Å; V416-V450 HydrophobicContact CG2-CG1 3.72Å; V416-L454 HydrophobicContact CG1-CD1 3.82Å; V416-I459 CarbonylContact C-O 3.59Å; V416-I459 WeakPolarHBondContact CA-O 3.4Å; V416-V460 HydrophobicContact CG1-CG2 4.41Å; V416-V460 HydrophobicContact CG2-CG1 4.49Å; V416-V460 HydrophobicContact CG2-CG2 4.25Å
417	S	94.6	Very high	88.2	Confident	17 Å²	17	72.8 Å²	72.8	12%	0.119	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.9	174	-55.6	0	0	0	0	109.8	V437 I459	S417-V437 VanDerWaalsContact CA-O 3.26Å; S417-V437 WeakPolarHBondContact CA-O 3.24Å; S417-I459 PolarHBondContact N-O 3.48Å; S417-I459 PolarHBondContact O-N 2.97Å
418	Y	90.9	Very high	87.3	Confident	65 Å²	65	73 Å²	73	26%	0.255	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154.4	-179.8	58.4	-91.1	0	0	0	110.2	V416 V437 R439 D458	V416-Y418 HydrophobicContact CG1-CD1 4.3Å; Y418-V437 HydrophobicContact CD2-CB 4.49Å; Y418-V437 HydrophobicContact CE1-CB 4.42Å; Y418-V437 HydrophobicContact CE1-CG1 4.19Å; Y418-V437 HydrophobicContact CE2-CB 4.02Å; Y418-V437 HydrophobicContact CE2-CG1 4.35Å; Y418-V437 PolarHBondContact N-O 2.93Å; Y418-V437 PolarHBondContact O-N 3.41Å; Y418-R439 HydrophobicContact CE1-CB 4.15Å; Y418-D458 WeakPolarHBondContact CA-OD1 3.27Å; Y418-D458 VanDerWaalsContact CB-OD1 3.24Å; Y418-D458 WeakPolarHBondContact CB-OD1 3.13Å
419	K	85.7	Confident	86.3	Confident	115 Å²	115	73 Å²	73	50%	0.5	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	134.5	175.3	-75.5	-170.9	166.1	-129.1	0	111.1	D435 V436	K419-D435 WeakPolarHBondContact CE-OD2 3.5Å; K419-D435 IonicContact NZ-OD2 3.23Å; K419-D435 PolarHBondContact NZ-OD2 3.36Å; K419-V436 HydrophobicContact CG-CG2 4.09Å
420	L	83.5	Confident	85.4	Confident	31 Å²	31	72.8 Å²	72.8	16%	0.162	35%	0.348	C	S	.	.			trans	-61	151.6	165.2	-68.2	173.4	0	0	0	109.6	R424 E425 A428 D435 V437	L420-R424 HydrophobicContact CB-CB 4.3Å; L420-R424 HydrophobicContact CD1-CB 4.42Å; L420-R424 HydrophobicContact CD2-CB 4.14Å; L420-E425 HydrophobicContact CB-CB 4.34Å; L420-A428 HydrophobicContact CD1-CB 4.06Å; L420-D435 WeakPolarHBondContact CB-O 3.21Å; L420-D435 WeakPolarHBondContact CG-O 3.38Å; L420-D435 PolarHBondContact N-O 3.31Å; L420-V437 HydrophobicContact CD1-CG2 3.89Å; L420-V437 HydrophobicContact CD2-CG2 3.72Å; L420-V437 HydrophobicContact CG-CG2 3.67Å
421	R	80.6	Confident	84.5	Confident	137 Å²	137	73.3 Å²	73.3	52%	0.517	36%	0.363	S	S	.	.			trans	-134	149.4	-177.8	-57.3	-176.1	-173.5	-167.6	4	110.6
422	G	82.5	Confident	83.3	Confident	41 Å²	41	73.6 Å²	73.6	42%	0.423	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	-132.1	171.9	0	0	0	0	0	112.4	R424 E425 R426	G422-R424 VanDerWaalsContact C-N 3.3Å; G422-R424 PolarHBondContact O-N 3.11Å; G422-E425 PolarHBondContact N-OE2 3.06Å; G422-E425 WeakPolarHBondContact O-CB 3.44Å; G422-E425 PolarHBondContact O-N 2.75Å; G422-R426 PolarHBondContact O-N 3.17Å
423	E	78.8	Confident	82.2	Confident	149 Å²	149	78.1 Å²	78.1	70%	0.696	40%	0.4	S	S	*	.	H	α-helix	trans	-63.5	-34.3	-177.3	-69	-172.9	161.2	0	0	113.3	E425 R426 Q427	E423-E425 VanDerWaalsContact C-N 3.32Å; E423-E425 PolarHBondContact O-N 3.05Å; E423-R426 PolarHBondContact O-N 2.89Å; E423-Q427 WeakPolarHBondContact O-CB 3.46Å; E423-Q427 WeakPolarHBondContact O-CG 3.46Å; E423-Q427 PolarHBondContact O-N 3.44Å
424	R	79.5	Confident	81.3	Confident	177 Å²	177	81.8 Å²	81.8	67%	0.668	43%	0.426	S	S	*	.	H	α-helix	trans	-68.2	-33.9	-179.8	-66.4	-173.9	-177.3	174.1	1.9	112.5	L420 G422 A428	L420-R424 HydrophobicContact CB-CB 4.3Å; L420-R424 HydrophobicContact CD1-CB 4.42Å; L420-R424 HydrophobicContact CD2-CB 4.14Å; G422-R424 VanDerWaalsContact C-N 3.3Å; G422-R424 PolarHBondContact O-N 3.11Å; R424-A428 WeakPolarHBondContact O-CB 3.4Å; R424-A428 PolarHBondContact O-N 2.89Å
425	E	79.8	Confident	80.6	Confident	64 Å²	64	81.9 Å²	81.9	30%	0.299	43%	0.427	S	S	.	.	H	α-helix	trans	-64.3	-52.1	172.6	-176.2	-179.8	-168.4	0	0	109.9	L420 G422 E423 Q427 A428 E429	L420-E425 HydrophobicContact CB-CB 4.34Å; G422-E425 PolarHBondContact N-OE2 3.06Å; G422-E425 WeakPolarHBondContact O-CB 3.44Å; G422-E425 PolarHBondContact O-N 2.75Å; E423-E425 VanDerWaalsContact C-N 3.32Å; E423-E425 PolarHBondContact O-N 3.05Å; E425-Q427 VanDerWaalsContact C-N 3.29Å; E425-Q427 PolarHBondContact O-N 3.15Å; E425-A428 PolarHBondContact O-N 3.35Å; E425-A428 VanDerWaalsContact O-N 3.09Å; E425-E429 WeakPolarHBondContact O-CG 3.41Å; E425-E429 PolarHBondContact O-N 2.9Å
426	R	76.5	Confident	80.2	Confident	184 Å²	184	82.8 Å²	82.8	69%	0.694	44%	0.436	S	S	*	.	H	α-helix	trans	-59.3	-38.4	178.2	-65.3	-179.3	-171.5	176.2	2.6	112.9	G422 E423 A430	G422-R426 PolarHBondContact O-N 3.17Å; E423-R426 PolarHBondContact O-N 2.89Å; R426-A430 VanDerWaalsContact O-CB 3.24Å; R426-A430 WeakPolarHBondContact O-CB 3.24Å; R426-A430 PolarHBondContact O-N 2.83Å
427	Q	77.2	Confident	79.8	Confident	123 Å²	123	84.9 Å²	84.9	58%	0.575	45%	0.448	S	S	*	.	H	α-helix	trans	-67.6	-42	175.6	-76.2	177.5	3.3	0	0	112.1	E423 E425 A430 S431	E423-Q427 WeakPolarHBondContact O-CB 3.46Å; E423-Q427 WeakPolarHBondContact O-CG 3.46Å; E423-Q427 PolarHBondContact O-N 3.44Å; E425-Q427 VanDerWaalsContact C-N 3.29Å; E425-Q427 PolarHBondContact O-N 3.15Å; Q427-A430 PolarHBondContact O-N 3.2Å; Q427-S431 WeakPolarHBondContact O-CB 3.48Å; Q427-S431 PolarHBondContact O-N 3.5Å; Q427-S431 PolarHBondContact O-OG 3Å
428	A	76.2	Confident	79.6	Confident	12 Å²	12	90.4 Å²	90.4	10%	0.099	47%	0.466	C	S	.	.	H	α-helix	trans	-62.8	-45.9	177	0	0	0	0	0	111.2	L420 R424 E425 S431 G432 N433	L420-A428 HydrophobicContact CD1-CB 4.06Å; R424-A428 WeakPolarHBondContact O-CB 3.4Å; R424-A428 PolarHBondContact O-N 2.89Å; E425-A428 PolarHBondContact O-N 3.35Å; E425-A428 VanDerWaalsContact O-N 3.09Å; A428-S431 CarbonylContact O-C 3.1Å; A428-S431 PolarHBondContact O-N 3.23Å; A428-G432 PolarHBondContact O-N 3.34Å; A428-G432 VanDerWaalsContact O-N 3.11Å; A428-N433 CarbonylContact C-O 3.51Å; A428-N433 PolarHBondContact O-N 3.37Å
429	E	72	Confident	79.5	Confident	118 Å²	118	91.6 Å²	91.6	55%	0.551	47%	0.471	S	S	*	.	H	α-helix	trans	-61	-47.5	176	-71.2	-178.2	157.4	0	0	112.1	E425 S431 G432	E425-E429 WeakPolarHBondContact O-CG 3.41Å; E425-E429 PolarHBondContact O-N 2.9Å; E429-S431 PolarHBondContact O-N 3.35Å; E429-G432 PolarHBondContact O-N 2.82Å
430	A	73.4	Confident	79.8	Confident	91 Å²	91	90.8 Å²	90.8	75%	0.752	47%	0.467	S	S	*	.	H	α-helix	trans	-61	-28.3	176.9	0	0	0	0	0	112.8	R426 Q427	R426-A430 VanDerWaalsContact O-CB 3.24Å; R426-A430 WeakPolarHBondContact O-CB 3.24Å; R426-A430 PolarHBondContact O-N 2.83Å; Q427-A430 PolarHBondContact O-N 3.2Å
431	S	73.3	Confident	80.1	Confident	86 Å²	86	89.3 Å²	89.3	60%	0.601	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-2.5	177.8	-48.3	0	0	0	0	113.6	Q427 A428 E429 N433	Q427-S431 WeakPolarHBondContact O-CB 3.48Å; Q427-S431 PolarHBondContact O-N 3.5Å; Q427-S431 PolarHBondContact O-OG 3Å; A428-S431 CarbonylContact O-C 3.1Å; A428-S431 PolarHBondContact O-N 3.23Å; E429-S431 PolarHBondContact O-N 3.35Å; S431-N433 PolarHBondContact O-N 3.48Å
432	G	69.4	Low	80.3	Confident	62 Å²	62	85 Å²	85	64%	0.639	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	19.9	-174.8	0	0	0	0	0	114.5	A428 E429	A428-G432 PolarHBondContact O-N 3.34Å; A428-G432 VanDerWaalsContact O-N 3.11Å; E429-G432 PolarHBondContact O-N 2.82Å
433	N	72.7	Confident	80.5	Confident	95 Å²	95	86.6 Å²	86.6	51%	0.508	46%	0.456	S	S	.	.			trans	-95.5	155.1	175.1	-82.6	-23	0	0	0	111	A428 S431 D435	A428-N433 CarbonylContact C-O 3.51Å; A428-N433 PolarHBondContact O-N 3.37Å; S431-N433 PolarHBondContact O-N 3.48Å; N433-D435 PolarHBondContact O-N 3.27Å
434	S	75.6	Confident	80.8	Confident	77 Å²	77	86.9 Å²	86.9	54%	0.538	46%	0.457	S	S	.	.			trans	-58.3	132.9	176.5	172.8	0	0	0	0	111.2	V436	S434-V436 PolarHBondContact O-N 3Å; S434-V436 WeakPolarHBondContact OG-CB 3.31Å; S434-V436 PolarHBondContact OG-N 3.02Å; S434-V436 PolarHBondContact OG-O 3.23Å; S434-V436 VanDerWaalsContact OG-O 3.1Å
435	D	81.3	Confident	80.9	Confident	35 Å²	35	89.3 Å²	89.3	19%	0.187	47%	0.467	C	S	.	.	S	Bend	trans	-68.4	-19.9	168.9	64.4	-33.2	0	0	0	112	K419 L420 N433	K419-D435 WeakPolarHBondContact CE-OD2 3.5Å; K419-D435 IonicContact NZ-OD2 3.23Å; K419-D435 PolarHBondContact NZ-OD2 3.36Å; L420-D435 WeakPolarHBondContact CB-O 3.21Å; L420-D435 WeakPolarHBondContact CG-O 3.38Å; L420-D435 PolarHBondContact N-O 3.31Å; N433-D435 PolarHBondContact O-N 3.27Å
436	V	85.1	Confident	81.1	Confident	59 Å²	59	86.5 Å²	86.5	36%	0.358	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.4	175.5	-174.7	0	0	0	0	110.8	K419 S434	K419-V436 HydrophobicContact CG-CG2 4.09Å; S434-V436 PolarHBondContact O-N 3Å; S434-V436 WeakPolarHBondContact OG-CB 3.31Å; S434-V436 PolarHBondContact OG-N 3.02Å; S434-V436 PolarHBondContact OG-O 3.23Å; S434-V436 VanDerWaalsContact OG-O 3.1Å
437	V	87.2	Confident	81.8	Confident	44 Å²	44	78.7 Å²	78.7	27%	0.267	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.1	171.3	173.7	0	0	0	0	109.1	S417 Y418 L420	S417-V437 VanDerWaalsContact CA-O 3.26Å; S417-V437 WeakPolarHBondContact CA-O 3.24Å; Y418-V437 HydrophobicContact CD2-CB 4.49Å; Y418-V437 HydrophobicContact CE1-CB 4.42Å; Y418-V437 HydrophobicContact CE1-CG1 4.19Å; Y418-V437 HydrophobicContact CE2-CB 4.02Å; Y418-V437 HydrophobicContact CE2-CG1 4.35Å; Y418-V437 PolarHBondContact N-O 2.93Å; Y418-V437 PolarHBondContact O-N 3.41Å; L420-V437 HydrophobicContact CD1-CG2 3.89Å; L420-V437 HydrophobicContact CD2-CG2 3.72Å; L420-V437 HydrophobicContact CG-CG2 3.67Å
438	R	90.8	Very high	82.4	Confident	134 Å²	134	79.7 Å²	79.7	51%	0.506	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	106.1	171.9	-175.5	172.6	-176.1	-110.7	1.8	109.5	F415 E461	F415-R438 HydrophobicContact CB-CG 4.28Å; F415-R438 HydrophobicContact CD1-CG 4.06Å; F415-R438 HydrophobicContact CG-CG 4.44Å; R438-E461 IonicContact CZ-OE1 3.34Å; R438-E461 IonicContact CZ-OE2 3.86Å; R438-E461 IonicContact NE-OE1 2.81Å; R438-E461 PolarHBondContact NE-OE1 3.07Å; R438-E461 IonicContact NH2-OE1 3.02Å; R438-E461 PolarHBondContact NH2-OE1 3.12Å; R438-E461 IonicContact NH2-OE2 2.86Å; R438-E461 PolarHBondContact NH2-OE2 3.47Å
439	R	89.2	Confident	83	Confident	90 Å²	90	83.3 Å²	83.3	34%	0.34	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.6	-177.3	-168.4	167.5	-179.5	178	-2.3	110.9	F415 V416 Y418	F415-R439 VanDerWaalsContact CA-O 3.28Å; F415-R439 WeakPolarHBondContact CA-O 3.28Å; V416-R439 PolarHBondContact N-O 3.42Å; V416-R439 PolarHBondContact O-N 3.02Å; Y418-R439 HydrophobicContact CE1-CB 4.15Å
440	F	91.6	Very high	83.9	Confident	97 Å²	97	78.1 Å²	78.1	43%	0.425	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.5	175	-172.7	-136.9	0	0	0	110.8	M414 F415 A442	M414-F440 HydrophobicContact CE-CD2 4.12Å; M414-F440 HydrophobicContact CE-CE2 3.03Å; M414-F440 HydrophobicContact CE-CZ 3.3Å; M414-F440 HydrophobicContact CG-CD2 4.44Å; M414-F440 HydrophobicContact CG-CE2 3.9Å; M414-F440 WeakPolarHBondContact O-CD2 3.43Å; M414-F440 HydrophobicContact SD-CE2 4.24Å; F415-F440 HydrophobicContact CD1-CB 4.03Å; F415-F440 AromaticContact CD1-CD2 3.72Å; F415-F440 HydrophobicContact CD1-CD2 3.72Å; F415-F440 HydrophobicContact CD1-CG 4.35Å; F415-F440 HydrophobicContact CE1-CB 3.83Å; F415-F440 AromaticContact CE1-CD2 3.21Å; F415-F440 HydrophobicContact CE1-CD2 3.21Å; F415-F440 AromaticContact CE1-CE2 3.93Å; F415-F440 HydrophobicContact CE1-CE2 3.93Å; F415-F440 AromaticContact CE1-CG 3.86Å; F415-F440 HydrophobicContact CE1-CG 3.86Å; F415-F440 HydrophobicContact CE2-CD2 4.13Å; F415-F440 HydrophobicContact CE2-CE2 4.19Å; F415-F440 HydrophobicContact CG-CD2 4.36Å; F415-F440 AromaticContact CZ-CD2 3.43Å; F415-F440 HydrophobicContact CZ-CD2 3.43Å; F415-F440 VanDerWaalsContact CZ-CD2 3.43Å; F415-F440 AromaticContact CZ-CE2 3.64Å; F415-F440 HydrophobicContact CZ-CE2 3.64Å; F415-F440 HydrophobicContact CZ-CG 4.4Å; F440-A442 VanDerWaalsContact C-N 3.28Å; F440-A442 HydrophobicContact CD1-CB 3.47Å; F440-A442 VanDerWaalsContact CD1-CB 3.47Å; F440-A442 HydrophobicContact CE1-CB 3.25Å; F440-A442 HydrophobicContact CG-CB 4.34Å; F440-A442 HydrophobicContact CZ-CB 4Å; F440-A442 PolarHBondContact O-N 3.09Å
441	L	88.9	Confident	84.7	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.389	C	S	.	.			trans	-86.5	21.8	-176.3	-64.7	179.2	0	0	0	113.8	V403 P407 A413 M414 V416 H447 V450	V403-L441 HydrophobicContact CB-CD1 4.44Å; V403-L441 HydrophobicContact CG1-CD1 4.07Å; V403-L441 HydrophobicContact CG1-CD2 4.21Å; V403-L441 HydrophobicContact CG2-CD1 4.32Å; P407-L441 WeakPolarHBondContact CD-O 3.36Å; P407-L441 WeakPolarHBondContact CG-O 3.42Å; A413-L441 HydrophobicContact CB-CD1 3.93Å; M414-L441 PolarHBondContact O-N 2.81Å; V416-L441 HydrophobicContact CG2-CD1 3.91Å; V416-L441 HydrophobicContact CG2-CD2 4.17Å; V416-L441 HydrophobicContact CG2-CG 4.25Å; L441-H447 PolarHBondContact O-CD2 3.18Å; L441-H447 PolarHBondContact O-NE2 3.11Å; L441-V450 HydrophobicContact CD2-CB 4.31Å; L441-V450 HydrophobicContact CD2-CG1 4.28Å; L441-V450 HydrophobicContact CD2-CG2 4.33Å
442	A	85.9	Confident	85.5	Confident	47 Å²	47	76.9 Å²	76.9	39%	0.388	39%	0.391	S	S	.	.			trans	-62.5	-40.5	177.3	0	0	0	0	0	115.2	F440 E444	F440-A442 VanDerWaalsContact C-N 3.28Å; F440-A442 HydrophobicContact CD1-CB 3.47Å; F440-A442 VanDerWaalsContact CD1-CB 3.47Å; F440-A442 HydrophobicContact CE1-CB 3.25Å; F440-A442 HydrophobicContact CG-CB 4.34Å; F440-A442 HydrophobicContact CZ-CB 4Å; F440-A442 PolarHBondContact O-N 3.09Å; A442-E444 PolarHBondContact O-N 3.26Å
443	P	86.7	Confident	86.5	Confident	74 Å²	74	81.2 Å²	81.2	48%	0.481	39%	0.389	S	S	.	.	S	Bend	trans	-77.8	123.7	178.8	-8.8	25.2	0	0	0	111.1	R445 A446 H447	P443-R445 VanDerWaalsContact C-N 3.27Å; P443-R445 PolarHBondContact O-N 3.41Å; P443-A446 HydrophobicContact CB-CB 4.41Å; P443-A446 VanDerWaalsContact O-CB 3.28Å; P443-A446 WeakPolarHBondContact O-CB 3.37Å; P443-A446 PolarHBondContact O-N 3.21Å; P443-H447 PolarHBondContact O-CD2 3.35Å
444	E	83.9	Confident	87.4	Confident	155 Å²	155	76.9 Å²	76.9	72%	0.724	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-37.9	179.8	-67.6	177.9	173.5	0	0	113	A442 A446 H447	A442-E444 PolarHBondContact O-N 3.26Å; E444-A446 PolarHBondContact O-N 3.41Å; E444-A446 VanDerWaalsContact O-N 3.07Å; E444-H447 VanDerWaalsContact O-CB 3.29Å; E444-H447 WeakPolarHBondContact O-CB 3.31Å; E444-H447 VanDerWaalsContact O-CG 3.3Å; E444-H447 PolarHBondContact O-N 3.09Å
445	R	83.4	Confident	88.2	Confident	229 Å²	229	77.1 Å²	77.1	86%	0.864	36%	0.359	S	S	*	.	H	α-helix	trans	-59	-24.5	176.1	-61.9	-177.3	-174	169.8	1.6	113.4	P443 H447	P443-R445 VanDerWaalsContact C-N 3.27Å; P443-R445 PolarHBondContact O-N 3.41Å; R445-H447 VanDerWaalsContact C-N 3.32Å
446	A	84.1	Confident	88.8	Confident	4 Å²	4	78 Å²	78	3%	0.033	37%	0.368	C	S	.	.	H	α-helix	trans	-78.3	-18.8	178.8	0	0	0	0	0	112.5	P443 E444 V450	P443-A446 HydrophobicContact CB-CB 4.41Å; P443-A446 VanDerWaalsContact O-CB 3.28Å; P443-A446 WeakPolarHBondContact O-CB 3.37Å; P443-A446 PolarHBondContact O-N 3.21Å; E444-A446 PolarHBondContact O-N 3.41Å; E444-A446 VanDerWaalsContact O-N 3.07Å; A446-V450 VanDerWaalsContact O-CB 3.27Å; A446-V450 WeakPolarHBondContact O-CB 3.4Å; A446-V450 WeakPolarHBondContact O-CG2 3.33Å; A446-V450 PolarHBondContact O-N 3.18Å
447	H	90	Very high	89.1	Confident	20 Å²	20	77.2 Å²	77.2	9%	0.093	37%	0.372	C	S	.	.	H	α-helix	trans	-64.9	-53.9	-174.3	-59.8	173.4	0	0	0	111	L404 L441 P443 E444 R445 D449 V450 A451	L404-H447 PolarHBondContact O-ND1 3.28Å; L441-H447 PolarHBondContact O-CD2 3.18Å; L441-H447 PolarHBondContact O-NE2 3.11Å; P443-H447 PolarHBondContact O-CD2 3.35Å; E444-H447 VanDerWaalsContact O-CB 3.29Å; E444-H447 WeakPolarHBondContact O-CB 3.31Å; E444-H447 VanDerWaalsContact O-CG 3.3Å; E444-H447 PolarHBondContact O-N 3.09Å; R445-H447 VanDerWaalsContact C-N 3.32Å; H447-D449 PolarHBondContact O-N 3.15Å; H447-V450 PolarHBondContact O-N 3.17Å; H447-A451 WeakPolarHBondContact O-CB 3.48Å; H447-A451 PolarHBondContact O-N 2.92Å
448	E	89.9	Confident	89.4	Confident	145 Å²	145	75.7 Å²	75.7	68%	0.678	36%	0.362	S	S	*	.	H	α-helix	trans	-60.6	-46.8	180	-66.7	-176.2	171.9	0	0	112.1	L404 A451 K452	L404-E448 HydrophobicContact CD2-CG 4.23Å; E448-A451 PolarHBondContact O-N 3.05Å; E448-K452 VanDerWaalsContact O-CB 3.26Å; E448-K452 WeakPolarHBondContact O-CB 3.41Å; E448-K452 PolarHBondContact O-N 3.04Å
449	D	89.1	Confident	89.7	Confident	87 Å²	87	72 Å²	72	47%	0.465	35%	0.351	S	S	.	.	H	α-helix	trans	-60.4	-50.6	179	-83.7	-14.5	0	0	0	111.4	H447 K452 Y453	H447-D449 PolarHBondContact O-N 3.15Å; D449-K452 PolarHBondContact O-N 2.94Å; D449-Y453 WeakPolarHBondContact O-CD2 3.46Å; D449-Y453 PolarHBondContact O-N 3.4Å
450	V	89.8	Confident	90	Very high	9 Å²	9	67.7 Å²	67.7	6%	0.055	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-40.5	-177.7	176.9	0	0	0	0	110.9	V403 V416 L441 A446 H447 K452 Y453 L454	V403-V450 HydrophobicContact CG1-CB 4.17Å; V403-V450 HydrophobicContact CG1-CG1 4.01Å; V416-V450 HydrophobicContact CB-CG1 3.84Å; V416-V450 HydrophobicContact CG1-CG1 3.91Å; V416-V450 HydrophobicContact CG2-CG1 3.72Å; L441-V450 HydrophobicContact CD2-CB 4.31Å; L441-V450 HydrophobicContact CD2-CG1 4.28Å; L441-V450 HydrophobicContact CD2-CG2 4.33Å; A446-V450 VanDerWaalsContact O-CB 3.27Å; A446-V450 WeakPolarHBondContact O-CB 3.4Å; A446-V450 WeakPolarHBondContact O-CG2 3.33Å; A446-V450 PolarHBondContact O-N 3.18Å; H447-V450 PolarHBondContact O-N 3.17Å; V450-K452 VanDerWaalsContact C-N 3.34Å; V450-K452 PolarHBondContact O-N 3.45Å; V450-Y453 PolarHBondContact O-N 2.91Å; V450-L454 PolarHBondContact O-N 3.04Å
451	A	90.5	Very high	90.2	Very high	3 Å²	3	64 Å²	64	3%	0.025	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-40.7	176.6	0	0	0	0	0	112.3	R400 V403 L404 H447 E448	R400-A451 HydrophobicContact CG-CB 3.79Å; R400-A451 PolarHBondContact NE-O 2.76Å; V403-A451 HydrophobicContact CB-CB 4.42Å; V403-A451 HydrophobicContact CG1-CB 4.01Å; L404-A451 HydrophobicContact CD2-CB 3.64Å; L404-A451 HydrophobicContact CG-CB 3.76Å; H447-A451 WeakPolarHBondContact O-CB 3.48Å; H447-A451 PolarHBondContact O-N 2.92Å; E448-A451 PolarHBondContact O-N 3.05Å
452	K	91	Very high	90.5	Very high	148 Å²	148	65 Å²	65	64%	0.643	32%	0.323	S	S	*	.	H	α-helix	trans	-65.1	-39.7	179.1	-175.4	178.4	-179	179.1	0	112.5	E448 D449 V450	E448-K452 VanDerWaalsContact O-CB 3.26Å; E448-K452 WeakPolarHBondContact O-CB 3.41Å; E448-K452 PolarHBondContact O-N 3.04Å; D449-K452 PolarHBondContact O-N 2.94Å; V450-K452 VanDerWaalsContact C-N 3.34Å; V450-K452 PolarHBondContact O-N 3.45Å
453	Y	90.5	Very high	91	Very high	153 Å²	153	62.8 Å²	62.8	60%	0.6	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	7.4	-178.1	-63.7	-67.8	0	0	0	114.4	D449 V450 Q455	D449-Y453 WeakPolarHBondContact O-CD2 3.46Å; D449-Y453 PolarHBondContact O-N 3.4Å; V450-Y453 PolarHBondContact O-N 2.91Å; Y453-Q455 WeakPolarHBondContact O-CG 3.23Å
454	L	91.8	Very high	91.3	Very high	5 Å²	5	60.6 Å²	60.6	3%	0.026	29%	0.289	C	S	.	.			trans	-64.9	132.3	176.9	-165.7	70.3	0	0	0	110.8	V391 L396 L399 R400 V416 V450 D458 V460	V391-L454 HydrophobicContact CG1-CD2 4.49Å; V391-L454 HydrophobicContact CG1-CG 4.39Å; V391-L454 HydrophobicContact CG2-CD1 3.98Å; V391-L454 HydrophobicContact CG2-CD2 4.03Å; V391-L454 HydrophobicContact CG2-CG 3.97Å; L396-L454 HydrophobicContact CD1-CD2 4.3Å; L396-L454 HydrophobicContact CD1-CG 4.31Å; L399-L454 HydrophobicContact CB-CD2 4.2Å; R400-L454 HydrophobicContact CB-CD2 4.5Å; V416-L454 HydrophobicContact CG1-CD1 3.82Å; V450-L454 PolarHBondContact O-N 3.04Å; L454-D458 HydrophobicContact CD1-CB 4.09Å; L454-V460 HydrophobicContact CD1-CG2 3.84Å; L454-V460 HydrophobicContact CD2-CG2 4.12Å
455	Q	91.7	Very high	91.7	Very high	82 Å²	82	54.4 Å²	54.4	38%	0.383	26%	0.26	S	S	.	.			trans	-136.1	161.4	-176.3	-64	-173.1	21.3	0	0	113.2	V391 Y453 G457 D458	V391-Q455 WeakPolarHBondContact CB-O 3.41Å; V391-Q455 WeakPolarHBondContact CG1-O 3.38Å; Y453-Q455 WeakPolarHBondContact O-CG 3.23Å; Q455-G457 PolarHBondContact O-N 3.38Å; Q455-D458 PolarHBondContact N-OD2 3.42Å; Q455-D458 VanDerWaalsContact O-CB 3.32Å; Q455-D458 WeakPolarHBondContact O-CB 3.36Å; Q455-D458 PolarHBondContact O-N 2.88Å; Q455-D458 VanDerWaalsContact O-N 3.11Å
456	S	92.8	Very high	91.9	Very high	54 Å²	54	50.1 Å²	50.1	38%	0.378	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	129.4	174.5	-58.5	0	0	0	0	110.8	V391 D393	V391-S456 WeakPolarHBondContact O-CA 3.46Å; D393-S456 PolarHBondContact OD1-OG 3.23Å
457	G	91.8	Very high	91.4	Very high	42 Å²	42	60.9 Å²	60.9	43%	0.433	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-19.4	-173.4	0	0	0	0	0	115	V391 Q455	V391-G457 PolarHBondContact O-N 2.93Å; Q455-G457 PolarHBondContact O-N 3.38Å
458	D	94.3	Very high	89.9	Confident	11 Å²	11	61.9 Å²	61.9	6%	0.059	30%	0.303	C	S	.	.			trans	-68	163.6	171.8	-62.5	-24.9	0	0	0	110.8	R390 V391 Y418 L454 Q455	R390-D458 WeakPolarHBondContact CA-O 3.13Å; V391-D458 HydrophobicContact CB-CB 4.45Å; V391-D458 HydrophobicContact CG2-CB 4.04Å; V391-D458 WeakPolarHBondContact CG2-O 3.09Å; V391-D458 PolarHBondContact N-O 3.48Å; Y418-D458 WeakPolarHBondContact CA-OD1 3.27Å; Y418-D458 VanDerWaalsContact CB-OD1 3.24Å; Y418-D458 WeakPolarHBondContact CB-OD1 3.13Å; L454-D458 HydrophobicContact CD1-CB 4.09Å; Q455-D458 PolarHBondContact N-OD2 3.42Å; Q455-D458 VanDerWaalsContact O-CB 3.32Å; Q455-D458 WeakPolarHBondContact O-CB 3.36Å; Q455-D458 PolarHBondContact O-N 2.88Å; Q455-D458 VanDerWaalsContact O-N 3.11Å
459	I	96	Very high	87.6	Confident	56 Å²	56	63.5 Å²	63.5	29%	0.287	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122	179.4	-59	174.3	0	0	0	109.1	P388 V416 S417	P388-I459 HydrophobicContact CB-CG2 3.63Å; V416-I459 CarbonylContact C-O 3.59Å; V416-I459 WeakPolarHBondContact CA-O 3.4Å; S417-I459 PolarHBondContact N-O 3.48Å; S417-I459 PolarHBondContact O-N 2.97Å
460	V	96.2	Very high	85.5	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.4	174.4	179.9	0	0	0	0	108.7	Y387 E389 V391 L399 V403 A413 V416 L454 R462	Y387-V460 VanDerWaalsContact O-O 3.11Å; E389-V460 PolarHBondContact N-O 3.04Å; E389-V460 PolarHBondContact O-N 2.97Å; V391-V460 HydrophobicContact CG2-CG2 3.83Å; L399-V460 HydrophobicContact CB-CG2 4.24Å; L399-V460 HydrophobicContact CD1-CB 4.41Å; L399-V460 HydrophobicContact CD1-CG2 4.37Å; L399-V460 HydrophobicContact CD2-CB 4.35Å; L399-V460 HydrophobicContact CD2-CG1 4.49Å; V403-V460 HydrophobicContact CG2-CG1 3.86Å; V403-V460 HydrophobicContact CG2-CG2 4.12Å; A413-V460 HydrophobicContact CB-CG1 3.7Å; V416-V460 HydrophobicContact CG1-CG2 4.41Å; V416-V460 HydrophobicContact CG2-CG1 4.49Å; V416-V460 HydrophobicContact CG2-CG2 4.25Å; L454-V460 HydrophobicContact CD1-CG2 3.84Å; L454-V460 HydrophobicContact CD2-CG2 4.12Å; V460-R462 VanDerWaalsContact C-N 3.28Å; V460-R462 HydrophobicContact CG1-CB 4.42Å; V460-R462 PolarHBondContact O-N 3.45Å
461	E	96.4	Very high	85.3	Confident	20 Å²	20	70.4 Å²	70.4	9%	0.093	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	79.4	170.8	-69.2	-176.5	-146.5	0	0	109.1	T386 Y387 P388 M414 F415 R438	T386-E461 HydrophobicContact CG2-CB 4.34Å; T386-E461 PolarHBondContact OG1-OE2 3.4Å; Y387-E461 WeakPolarHBondContact O-CA 3.26Å; P388-E461 HydrophobicContact CB-CG 4.49Å; M414-E461 PolarHBondContact N-O 3.45Å; F415-E461 HydrophobicContact CB-CB 4.03Å; F415-E461 HydrophobicContact CB-CG 4.19Å; F415-E461 WeakPolarHBondContact CD2-OE2 3.39Å; F415-E461 PolarHBondContact O-N 3.42Å; R438-E461 IonicContact CZ-OE1 3.34Å; R438-E461 IonicContact CZ-OE2 3.86Å; R438-E461 IonicContact NE-OE1 2.81Å; R438-E461 PolarHBondContact NE-OE1 3.07Å; R438-E461 IonicContact NH2-OE1 3.02Å; R438-E461 PolarHBondContact NH2-OE1 3.12Å; R438-E461 IonicContact NH2-OE2 2.86Å; R438-E461 PolarHBondContact NH2-OE2 3.47Å
462	R	95.2	Very high	85	Confident	22 Å²	22	73.9 Å²	73.9	8%	0.083	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	159.1	179.5	62.3	159.8	175.8	83.2	-0.9	112.2	T386 Y387 E389 L402 A413 V460	T386-R462 CarbonylContact C-O 3.56Å; T386-R462 WeakPolarHBondContact CA-O 3.5Å; T386-R462 WeakPolarHBondContact CB-O 3.48Å; Y387-R462 PolarHBondContact N-O 2.91Å; Y387-R462 PolarHBondContact O-N 2.87Å; Y387-R462 VanDerWaalsContact O-N 3.13Å; E389-R462 HydrophobicContact CB-CG 4.45Å; E389-R462 IonicContact OE2-CZ 3.81Å; E389-R462 IonicContact OE2-NE 2.7Å; E389-R462 PolarHBondContact OE2-NE 3.31Å; E389-R462 IonicContact OE2-NH2 2.77Å; E389-R462 PolarHBondContact OE2-NH2 3.08Å; L402-R462 HydrophobicContact CD1-CB 3.82Å; L402-R462 HydrophobicContact CD1-CG 4.45Å; A413-R462 HydrophobicContact CB-CB 4.46Å; V460-R462 VanDerWaalsContact C-N 3.28Å; V460-R462 HydrophobicContact CG1-CB 4.42Å; V460-R462 PolarHBondContact O-N 3.45Å
463	H	95.6	Very high	84.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	158.5	168.7	-63.1	157.9	0	0	0	111.5	A382 K383 P407 N409 Y410 G412 L465	A382-H463 WeakPolarHBondContact O-CB 3.07Å; K383-H463 PolarHBondContact O-CD2 3.35Å; K383-H463 PolarHBondContact O-NE2 3.16Å; P407-H463 PolarHBondContact O-CE1 3.42Å; P407-H463 PolarHBondContact O-NE2 2.69Å; N409-H463 PolarHBondContact O-CE1 3.47Å; N409-H463 PolarHBondContact O-ND1 2.93Å; Y410-H463 HydrophobicContact CD2-CB 4.1Å; Y410-H463 HydrophobicContact CE2-CB 4.27Å; G412-H463 WeakPolarHBondContact CA-ND1 3.23Å; G412-H463 PolarHBondContact N-ND1 2.96Å; G412-H463 PolarHBondContact O-N 2.72Å; H463-L465 PolarHBondContact O-N 2.94Å
464	L	94.1	Very high	84.3	Confident	28 Å²	28	64.9 Å²	64.9	15%	0.147	34%	0.337	C	S	.	.			trans	-71.9	109.7	174	-164.9	149.2	0	0	0	109	I377 A382 L385 Y410 P468 I470	I377-L464 HydrophobicContact CD1-CD1 4.24Å; I377-L464 HydrophobicContact CD1-CD2 3.59Å; A382-L464 HydrophobicContact CB-CB 4.19Å; A382-L464 PolarHBondContact O-N 2.97Å; L385-L464 HydrophobicContact CB-CD1 4.14Å; L385-L464 HydrophobicContact CD1-CD1 4.41Å; L385-L464 WeakPolarHBondContact O-CB 3.39Å; L385-L464 PolarHBondContact O-N 3.25Å; Y410-L464 VanDerWaalsContact CE2-O 3.23Å; Y410-L464 WeakPolarHBondContact CE2-O 3.26Å; Y410-L464 PolarHBondContact OH-O 3.07Å; L464-P468 HydrophobicContact CD2-CG 3.76Å; L464-P468 HydrophobicContact CG-CG 4.13Å; L464-I470 HydrophobicContact CD1-CD1 3.93Å; L464-I470 HydrophobicContact CD2-CD1 4.19Å; L464-I470 HydrophobicContact CG-CD1 4.39Å
465	L	92.7	Very high	83.9	Confident	24 Å²	24	68.7 Å²	68.7	13%	0.126	36%	0.356	C	S	.	.			trans	-89.4	172.1	-177.5	-57.2	176.7	0	0	0	111.2	F398 L402 Y410 P411 H463 P468	F398-L465 HydrophobicContact CE1-CD1 3.82Å; F398-L465 HydrophobicContact CZ-CD1 3.5Å; F398-L465 VanDerWaalsContact CZ-CD1 3.5Å; L402-L465 HydrophobicContact CD1-CD1 4.3Å; Y410-L465 HydrophobicContact CE2-CD2 4.47Å; P411-L465 HydrophobicContact CB-CD2 3.3Å; H463-L465 PolarHBondContact O-N 2.94Å; L465-P468 WeakPolarHBondContact O-CD 3.28Å; L465-P468 WeakPolarHBondContact O-CG 3.29Å
466	D	87.4	Confident	83.3	Confident	140 Å²	140	67.8 Å²	67.8	75%	0.749	35%	0.354	S	S	*	.	S	Bend	trans	-69.2	144	169.9	-57.6	-26.3	0	0	0	110.8
467	R	73.6	Confident	82.7	Confident	230 Å²	230	68.8 Å²	68.8	87%	0.868	35%	0.353	S	S	*	.	S	Bend	trans	55	46.3	-168	-54.2	-176	178.1	176.9	1.1	116.1
468	P	58.6	Low	82	Confident	41 Å²	41	70.8 Å²	70.8	27%	0.266	35%	0.347	S	S	.	.			trans	-75.1	129.7	159.9	31.9	-18.6	0	0	0	106.2	L464 L465 I470	L464-P468 HydrophobicContact CD2-CG 3.76Å; L464-P468 HydrophobicContact CG-CG 4.13Å; L465-P468 WeakPolarHBondContact O-CD 3.28Å; L465-P468 WeakPolarHBondContact O-CG 3.29Å; P468-I470 HydrophobicContact CB-CG1 4.17Å; P468-I470 HydrophobicContact CG-CD1 3.78Å; P468-I470 HydrophobicContact CG-CG1 3.91Å; P468-I470 PolarHBondContact O-N 3.49Å
469	N	41	Very low	80.9	Confident	179 Å²	179	75.8 Å²	75.8	96%	0.957	37%	0.371	S	S	*	.			trans	-59.2	98.5	163.5	-76.3	-24.2	0	0	0	107.3
470	I	44.5	Very low	79.6	Confident	170 Å²	170	77.6 Å²	77.6	87%	0.872	38%	0.378	S	S	*	.			trans	-102.3	0	166.4	-66.8	174.1	0	0	0	107	I377 L464 P468	I377-I470 HydrophobicContact CD1-CD1 3.94Å; L464-I470 HydrophobicContact CD1-CD1 3.93Å; L464-I470 HydrophobicContact CD2-CD1 4.19Å; L464-I470 HydrophobicContact CG-CD1 4.39Å; P468-I470 HydrophobicContact CB-CG1 4.17Å; P468-I470 HydrophobicContact CG-CD1 3.78Å; P468-I470 HydrophobicContact CG-CG1 3.91Å; P468-I470 PolarHBondContact O-N 3.49Å

Retrieved 470 of 470 residues in 105.2 ms (Link to these results)

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