A0A077Z5S2_TRITR Loading...

Zona pellucida domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z5S2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 260 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.2	Very low	33.6	Very low	59 Å²	59	94.9 Å²	94.9	29%	0.291	51%	0.512	S	S	.	.				0	142.3	0	-93.4	177.3	-87.4	0	0	108.7	L26 I71 V84 C108 L109	M1-L26 HydrophobicContact CE-CD2 4.48Å; M1-I71 HydrophobicContact CE-CD1 3.89Å; M1-V84 HydrophobicContact CE-CG2 4.26Å; M1-V84 HydrophobicContact SD-CB 3.87Å; M1-V84 HydrophobicContact SD-CG2 3.52Å; M1-V84 VanDerWaalsContact SD-CG2 3.52Å; M1-C108 HydrophobicContact CB-CB 4.29Å; M1-C108 HydrophobicContact CG-CB 4.33Å; M1-C108 HydrophobicContact SD-CB 3.95Å; M1-L109 CarbonylContact C-O 3.56Å; M1-L109 WeakPolarHBondContact CA-O 3.24Å; M1-L109 WeakPolarHBondContact CB-O 3.25Å; M1-L109 VanDerWaalsContact CG-O 3.28Å; M1-L109 WeakPolarHBondContact CG-O 3.07Å
2	I	46.5	Very low	32.7	Very low	119 Å²	119	99.3 Å²	99.3	61%	0.61	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.1	172.9	-59.9	173.5	0	0	0	107.1	C108 L109	I2-C108 CarbonylContact O-C 3.32Å; I2-C108 VanDerWaalsContact O-CA 3.24Å; I2-C108 WeakPolarHBondContact O-CA 3.5Å; I2-L109 PolarHBondContact N-O 2.89Å; I2-L109 PolarHBondContact O-N 3.4Å
3	C	40.9	Very low	32.1	Very low	55 Å²	55	99.6 Å²	99.6	37%	0.372	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	133.3	-176.9	-53.9	0	0	0	0	111.7	V29 I106 I107 C108	C3-V29 VanDerWaalsContact SG-CG1 3.58Å; C3-I106 HydrophobicContact CB-CG2 4.15Å; C3-I107 CarbonylContact C-O 3.52Å; C3-I107 VanDerWaalsContact CA-O 3.25Å; C3-I107 WeakPolarHBondContact CA-O 3.15Å; C3-C108 HydrophobicContact CB-CB 4.11Å; C3-C108 WeakPolarHBondContact CB-SG 3.48Å; C3-C108 WeakPolarHBondContact SG-CB 3.06Å; C3-C108 CovalentContact SG-SG 2.04Å; C3-C108 PolarHBondContact SG-SG 2.72Å
4	S	43.6	Very low	31.5	Very low	65 Å²	65	98.5 Å²	98.5	46%	0.455	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139.4	150	178.9	50.5	0	0	0	0	111.5	I107	S4-I107 PolarHBondContact N-O 3.36Å; S4-I107 PolarHBondContact O-N 3.17Å
5	D	36.7	Very low	31.1	Very low	46 Å²	46	101.3 Å²	101.3	25%	0.246	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.5	126.6	171.7	-173.7	-19.3	0	0	0	109.9	R7 V8 L104 Y105	D5-R7 PolarHBondContact O-N 3.43Å; D5-R7 PolarHBondContact OD1-N 2.67Å; D5-R7 IonicContact OD1-NE 2.69Å; D5-R7 IonicContact OD2-CZ 3.14Å; D5-R7 IonicContact OD2-NE 2.89Å; D5-R7 IonicContact OD2-NH2 3.85Å; D5-R7 PolarHBondContact OD2-NH2 3.2Å; D5-V8 PolarHBondContact O-N 3.08Å; D5-V8 VanDerWaalsContact O-N 3.17Å; D5-L104 WeakPolarHBondContact OD2-CD2 3.23Å; D5-Y105 CarbonylContact C-O 3.57Å; D5-Y105 VanDerWaalsContact CA-O 3.25Å; D5-Y105 WeakPolarHBondContact CA-O 3.46Å
6	S	31.7	Very low	30.6	Very low	47 Å²	47	103.1 Å²	103.1	33%	0.329	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.4	-15.7	-178.6	75.2	0	0	0	0	114.1	V8 Y105	S6-V8 PolarHBondContact O-N 3.28Å; S6-Y105 PolarHBondContact N-O 3.38Å; S6-Y105 WeakPolarHBondContact OG-CB 3.28Å
7	R	27.8	Very low	30.2	Very low	128 Å²	128	103.4 Å²	103.4	48%	0.483	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.2	-6.7	174	-67.4	-178.7	-64.1	-179.8	2.6	113.6	D5 L103 Y105	D5-R7 PolarHBondContact O-N 3.43Å; D5-R7 PolarHBondContact OD1-N 2.67Å; D5-R7 IonicContact OD1-NE 2.69Å; D5-R7 IonicContact OD2-CZ 3.14Å; D5-R7 IonicContact OD2-NE 2.89Å; D5-R7 IonicContact OD2-NH2 3.85Å; D5-R7 PolarHBondContact OD2-NH2 3.2Å; R7-L103 PolarHBondContact NH1-O 3.29Å; R7-L103 PolarHBondContact NH2-O 2.97Å; R7-Y105 HydrophobicContact CG-CD2 4.36Å
8	V	26.3	Very low	29.9	Very low	107 Å²	107	106.2 Å²	106.2	65%	0.648	58%	0.575	S	S	*	*			trans	-103.9	76.4	173.8	-171.6	0	0	0	0	109	D5 S6 G10	D5-V8 PolarHBondContact O-N 3.08Å; D5-V8 VanDerWaalsContact O-N 3.17Å; S6-V8 PolarHBondContact O-N 3.28Å; V8-G10 PolarHBondContact O-N 2.85Å
9	Q	22.6	Very low	29.6	Very low	188 Å²	188	104.9 Å²	104.9	88%	0.879	58%	0.581	S	S	*	*			trans	-76.7	105.4	162	-72	-158.4	-10.1	0	0	108.7
10	G	22.8	Very low	29.2	Very low	53 Å²	53	109.2 Å²	109.2	55%	0.546	60%	0.596	S	S	.	*			trans	111.2	92.5	168.1	0	0	0	0	0	114.9	V8	V8-G10 PolarHBondContact O-N 2.85Å
11	K	24.3	Very low	29	Very low	177 Å²	177	108.7 Å²	108.7	77%	0.77	59%	0.592	S	S	*	*				173.5	126.9	113.4	-94.4	171	-177.9	173.1	0	109.8	S13 C257	K11-S13 PolarHBondContact O-N 2.94Å; K11-C257 PolarHBondContact NZ-SG 2.74Å
12	T	23	Very low	27.9	Very low	148 Å²	148	110.4 Å²	110.4	91%	0.908	61%	0.609	S	S	*	*			trans	-65.6	114.2	164.7	38.2	0	0	0	0	109.8
13	S	24.3	Very low	27.2	Very low	103 Å²	103	117.3 Å²	117.3	72%	0.72	63%	0.628	S	S	*	*			trans	-153.7	110.3	147.2	71.3	0	0	0	0	110.2	K11 Q15	K11-S13 PolarHBondContact O-N 2.94Å; S13-Q15 PolarHBondContact O-N 3.45Å
14	S	24.8	Very low	26.7	Very low	84 Å²	84	119.1 Å²	119.1	59%	0.587	65%	0.646	S	S	*	*			trans	-13.2	95.6	161	-174.7	0	0	0	0	115.6
15	Q	24.5	Very low	26.2	Very low	141 Å²	141	126.1 Å²	126.1	66%	0.659	67%	0.665	S	S	*	*			trans	-118.9	96.7	153.3	-83.7	-174.6	-29.4	0	0	107.3	S13 S17 D183	S13-Q15 PolarHBondContact O-N 3.45Å; Q15-S17 PolarHBondContact O-N 3.45Å; Q15-D183 PolarHBondContact NE2-OD2 3.32Å
16	R	24.2	Very low	26.8	Very low	130 Å²	130	128.5 Å²	128.5	49%	0.491	68%	0.677	S	S	.	*			trans	-78.1	99.7	173	-92.9	176.6	167.3	-176.4	0.9	108.6	Y18	R16-Y18 HydrophobicContact CB-CD2 4.31Å; R16-Y18 HydrophobicContact CB-CE2 3.91Å; R16-Y18 WeakPolarHBondContact CD-OH 3.13Å; R16-Y18 HydrophobicContact CG-CE2 4.29Å; R16-Y18 VanDerWaalsContact CZ-OH 3.28Å; R16-Y18 PolarHBondContact NE-OH 2.89Å; R16-Y18 PolarHBondContact NH1-OH 3.42Å
17	S	23.6	Very low	28.4	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	70%	0.695	S	S	*	*			trans	-92.7	108	156.2	-65	0	0	0	0	107.4	Q15 A19	Q15-S17 PolarHBondContact O-N 3.45Å; S17-A19 PolarHBondContact O-N 3.29Å
18	Y	24.3	Very low	30.5	Very low	154 Å²	154	133.3 Å²	133.3	60%	0.604	70%	0.697	S	S	*	*			trans	-77.1	108.8	173.2	-69.8	-90.2	0	0	0	109	R16	R16-Y18 HydrophobicContact CB-CD2 4.31Å; R16-Y18 HydrophobicContact CB-CE2 3.91Å; R16-Y18 WeakPolarHBondContact CD-OH 3.13Å; R16-Y18 HydrophobicContact CG-CE2 4.29Å; R16-Y18 VanDerWaalsContact CZ-OH 3.28Å; R16-Y18 PolarHBondContact NE-OH 2.89Å; R16-Y18 PolarHBondContact NH1-OH 3.42Å
19	A	23.5	Very low	32.7	Very low	83 Å²	83	129.1 Å²	129.1	69%	0.686	67%	0.672	S	S	*	*			trans	-86.9	113.6	154	0	0	0	0	0	107.1	S17 L21	S17-A19 PolarHBondContact O-N 3.29Å; A19-L21 PolarHBondContact O-N 2.83Å; A19-L21 VanDerWaalsContact O-N 3.13Å
20	H	22	Very low	35.2	Very low	190 Å²	190	127.7 Å²	127.7	88%	0.88	67%	0.665	S	S	*	*			trans	-63.6	108.6	175	-134.5	-86.7	0	0	0	108.5	S22	H20-S22 PolarHBondContact O-N 2.83Å
21	L	25.2	Very low	37.7	Very low	99 Å²	99	127.6 Å²	127.6	52%	0.518	65%	0.65	S	S	.	*			trans	-86	89.7	-179.8	-72.4	170.8	0	0	0	110	A19 L26	A19-L21 PolarHBondContact O-N 2.83Å; A19-L21 VanDerWaalsContact O-N 3.13Å; L21-L26 HydrophobicContact CD2-CD1 3.71Å; L21-L26 HydrophobicContact CD2-CD2 3.9Å; L21-L26 HydrophobicContact CD2-CG 3.85Å
22	S	23.2	Very low	40.3	Very low	94 Å²	94	121.4 Å²	121.4	66%	0.657	63%	0.629	S	S	*	*			trans	-74	139.2	153.9	61.7	0	0	0	0	108.8	H20 A24	H20-S22 PolarHBondContact O-N 2.83Å; S22-A24 PolarHBondContact O-N 2.81Å
23	R	31.8	Very low	43	Very low	265 Å²	265	115.4 Å²	115.4	100%	1	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	21.2	-155.5	-137.5	172	-177.6	173.6	-0.9	116.4
24	A	31	Very low	45.9	Very low	92 Å²	92	114 Å²	114	76%	0.76	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.3	18.1	-171.2	0	0	0	0	0	117.8	S22	S22-A24 PolarHBondContact O-N 2.81Å
25	Y	33.3	Very low	48.6	Very low	213 Å²	213	112.4 Å²	112.4	84%	0.835	56%	0.564	S	S	*	*			trans	-132.5	14	-173.4	-124.4	-97.8	0	0	0	117.6	Q27	Y25-Q27 VanDerWaalsContact C-N 3.26Å; Y25-Q27 PolarHBondContact O-N 2.04Å
26	L	48.2	Very low	51.3	Low	96 Å²	96	110.5 Å²	110.5	50%	0.503	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.1	51.7	-178.8	-80.4	171.1	0	0	0	114	M1 L21 I71	M1-L26 HydrophobicContact CE-CD2 4.48Å; L21-L26 HydrophobicContact CD2-CD1 3.71Å; L21-L26 HydrophobicContact CD2-CD2 3.9Å; L21-L26 HydrophobicContact CD2-CG 3.85Å; L26-I71 WeakPolarHBondContact O-CD1 3.24Å
27	Q	66.9	Low	54.1	Low	154 Å²	154	111.6 Å²	111.6	72%	0.72	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-7.6	169.9	-75.2	-172.1	-16.8	0	0	113.4	Y25 P70 I71	Y25-Q27 VanDerWaalsContact C-N 3.26Å; Y25-Q27 PolarHBondContact O-N 2.04Å; Q27-P70 CarbonylContact O-C 3.5Å; Q27-P70 WeakPolarHBondContact O-CA 3.06Å; Q27-I71 PolarHBondContact O-N 2.98Å
28	K	70.9	Confident	57.2	Low	121 Å²	121	111.8 Å²	111.8	53%	0.526	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137.9	146.9	-179	-57.6	-177.7	177.9	178.6	0	111.6	A68 I69	K28-A68 HydrophobicContact CB-CB 4.01Å; K28-A68 HydrophobicContact CD-CB 4.07Å; K28-I69 CarbonylContact C-O 3.51Å; K28-I69 WeakPolarHBondContact CA-O 3.3Å
29	V	73.2	Confident	60.3	Low	20 Å²	20	105.1 Å²	105.1	12%	0.121	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.8	170.9	179.5	0	0	0	0	108.5	C3 A68 I69 I71	C3-V29 VanDerWaalsContact SG-CG1 3.58Å; V29-A68 CarbonylContact O-C 3.57Å; V29-A68 WeakPolarHBondContact O-CA 3.47Å; V29-I69 PolarHBondContact N-O 2.86Å; V29-I69 PolarHBondContact O-N 3.4Å; V29-I71 HydrophobicContact CG2-CD1 3.88Å; V29-I71 HydrophobicContact CG2-CG1 3.87Å
30	H	73.4	Confident	63.5	Low	157 Å²	157	109.1 Å²	109.1	73%	0.727	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	131.7	174.8	-73.1	-98	0	0	0	110.6	F67	H30-F67 WeakPolarHBondContact CA-O 3.49Å
31	F	75.2	Confident	66.9	Low	51 Å²	51	100 Å²	100	22%	0.224	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.1	-179.8	-169	-102.5	0	0	0	110	I33 D66 F67 I69 L88 I106	F31-I33 HydrophobicContact CD1-CB 4.38Å; F31-I33 HydrophobicContact CE1-CB 3.88Å; F31-I33 HydrophobicContact CE1-CD1 4.46Å; F31-D66 WeakPolarHBondContact O-CA 3.48Å; F31-F67 HydrophobicContact CB-CD2 4.3Å; F31-F67 HydrophobicContact CB-CE2 3.98Å; F31-F67 HydrophobicContact CB-CZ 4.31Å; F31-F67 AromaticContact CD1-CE1 3.94Å; F31-F67 HydrophobicContact CD1-CE1 3.94Å; F31-F67 AromaticContact CD1-CE2 3.88Å; F31-F67 HydrophobicContact CD1-CE2 3.88Å; F31-F67 AromaticContact CD1-CZ 3.39Å; F31-F67 HydrophobicContact CD1-CZ 3.39Å; F31-F67 HydrophobicContact CE1-CZ 4.11Å; F31-F67 HydrophobicContact CG-CE2 4.32Å; F31-F67 HydrophobicContact CG-CZ 4.26Å; F31-F67 PolarHBondContact N-O 3.15Å; F31-F67 PolarHBondContact O-N 3.15Å; F31-I69 HydrophobicContact CB-CD1 4.44Å; F31-L88 HydrophobicContact CD1-CD1 4.18Å; F31-L88 HydrophobicContact CE1-CD1 4.12Å; F31-I106 HydrophobicContact CD2-CD1 3.85Å; F31-I106 HydrophobicContact CE2-CD1 3.83Å; F31-I106 HydrophobicContact CE2-CG1 4.31Å; F31-I106 HydrophobicContact CG-CD1 4.38Å; F31-I106 HydrophobicContact CZ-CD1 4.31Å
32	S	78.8	Confident	70.2	Confident	48 Å²	48	95.6 Å²	95.6	34%	0.336	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.6	175.9	-167.8	0	0	0	0	109.2	R64 Y65 D66	S32-R64 PolarHBondContact OG-NE 2.66Å; S32-R64 PolarHBondContact OG-NH2 3.42Å; S32-Y65 WeakPolarHBondContact CA-O 3.1Å; S32-D66 WeakPolarHBondContact CB-OD1 3.38Å; S32-D66 PolarHBondContact OG-OD1 2.94Å
33	I	80.4	Confident	73.5	Confident	21 Å²	21	91.1 Å²	91.1	11%	0.108	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.9	176.4	-168.3	165.1	0	0	0	109.5	F31 F35 I43 R64 Y65 F67 V90 L104	F31-I33 HydrophobicContact CD1-CB 4.38Å; F31-I33 HydrophobicContact CE1-CB 3.88Å; F31-I33 HydrophobicContact CE1-CD1 4.46Å; I33-F35 HydrophobicContact CD1-CE1 4.18Å; I33-F35 HydrophobicContact CD1-CE2 4.25Å; I33-F35 HydrophobicContact CD1-CZ 3.65Å; I33-F35 HydrophobicContact CG1-CE1 4.48Å; I33-F35 HydrophobicContact CG1-CE2 4.06Å; I33-F35 HydrophobicContact CG1-CZ 3.92Å; I33-F35 HydrophobicContact CG2-CE2 3.9Å; I33-F35 HydrophobicContact CG2-CZ 4.32Å; I33-I43 HydrophobicContact CD1-CD1 4.44Å; I33-I43 HydrophobicContact CG2-CD1 3.89Å; I33-R64 VanDerWaalsContact O-CA 3.29Å; I33-R64 WeakPolarHBondContact O-CA 3.47Å; I33-Y65 HydrophobicContact CG2-CD2 4.42Å; I33-Y65 PolarHBondContact N-O 2.92Å; I33-Y65 PolarHBondContact O-N 2.68Å; I33-F67 HydrophobicContact CG2-CE1 3.88Å; I33-V90 HydrophobicContact CD1-CG2 3.95Å; I33-L104 HydrophobicContact CD1-CD1 3.89Å
34	S	84.6	Confident	76.5	Confident	74 Å²	74	79.1 Å²	79.1	52%	0.517	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	143.9	177.1	-60.8	0	0	0	0	110.5	N63	S34-N63 CarbonylContact C-O 3.54Å; S34-N63 VanDerWaalsContact CA-O 3.25Å; S34-N63 WeakPolarHBondContact CA-O 3.04Å
35	F	82.6	Confident	79.4	Confident	51 Å²	51	74.7 Å²	74.7	22%	0.224	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	147.2	-175.5	-61.3	-83.9	0	0	0	109.8	I33 Q37 F39 I43 N63 Y65 V90	I33-F35 HydrophobicContact CD1-CE1 4.18Å; I33-F35 HydrophobicContact CD1-CE2 4.25Å; I33-F35 HydrophobicContact CD1-CZ 3.65Å; I33-F35 HydrophobicContact CG1-CE1 4.48Å; I33-F35 HydrophobicContact CG1-CE2 4.06Å; I33-F35 HydrophobicContact CG1-CZ 3.92Å; I33-F35 HydrophobicContact CG2-CE2 3.9Å; I33-F35 HydrophobicContact CG2-CZ 4.32Å; F35-Q37 VanDerWaalsContact CB-O 3.22Å; F35-Q37 WeakPolarHBondContact CB-O 3.37Å; F35-Q37 PolarHBondContact O-N 3.48Å; F35-F39 HydrophobicContact CB-CB 4.34Å; F35-F39 HydrophobicContact CD1-CB 4.24Å; F35-F39 HydrophobicContact CD1-CD2 4.12Å; F35-F39 HydrophobicContact CD1-CG 4.41Å; F35-F39 HydrophobicContact CD2-CB 3.53Å; F35-F39 HydrophobicContact CD2-CD2 4.49Å; F35-F39 HydrophobicContact CD2-CG 4Å; F35-F39 HydrophobicContact CE1-CB 4.45Å; F35-F39 AromaticContact CE1-CD2 3.71Å; F35-F39 HydrophobicContact CE1-CD2 3.71Å; F35-F39 HydrophobicContact CE1-CE2 4.17Å; F35-F39 HydrophobicContact CE1-CG 4.15Å; F35-F39 HydrophobicContact CE2-CB 3.78Å; F35-F39 HydrophobicContact CE2-CD1 4.03Å; F35-F39 HydrophobicContact CE2-CD2 4.12Å; F35-F39 AromaticContact CE2-CG 3.71Å; F35-F39 HydrophobicContact CE2-CG 3.71Å; F35-F39 HydrophobicContact CG-CB 3.78Å; F35-F39 HydrophobicContact CG-CD2 4.48Å; F35-F39 HydrophobicContact CG-CG 4.34Å; F35-F39 HydrophobicContact CZ-CB 4.23Å; F35-F39 HydrophobicContact CZ-CD1 4.21Å; F35-F39 AromaticContact CZ-CD2 3.71Å; F35-F39 HydrophobicContact CZ-CD2 3.71Å; F35-F39 HydrophobicContact CZ-CE2 4.05Å; F35-F39 AromaticContact CZ-CG 3.79Å; F35-F39 HydrophobicContact CZ-CG 3.79Å; F35-F39 HydrophobicContact CZ-CZ 4.42Å; F35-I43 HydrophobicContact CE2-CD1 4.26Å; F35-I43 HydrophobicContact CZ-CD1 4.03Å; F35-N63 PolarHBondContact N-O 2.92Å; F35-Y65 HydrophobicContact CD2-CD2 4.4Å; F35-Y65 HydrophobicContact CD2-CE2 4.49Å; F35-Y65 AromaticContact CE2-CD2 3.96Å; F35-Y65 HydrophobicContact CE2-CD2 3.96Å; F35-Y65 HydrophobicContact CE2-CE2 4.22Å; F35-V90 HydrophobicContact CE1-CG1 3.81Å; F35-V90 HydrophobicContact CZ-CG1 3.81Å
36	S	81.6	Confident	82.1	Confident	101 Å²	101	66.6 Å²	66.6	71%	0.706	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	-23.7	175.8	56	0	0	0	0	113.2
37	Q	83.1	Confident	84	Confident	152 Å²	152	64.8 Å²	64.8	71%	0.71	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	166	178.9	-60.7	-178.2	22.7	0	0	109.4	F35 F39	F35-Q37 VanDerWaalsContact CB-O 3.22Å; F35-Q37 WeakPolarHBondContact CB-O 3.37Å; F35-Q37 PolarHBondContact O-N 3.48Å; Q37-F39 PolarHBondContact O-N 2.91Å; Q37-F39 VanDerWaalsContact O-N 3.1Å
38	L	88.4	Confident	85.2	Confident	111 Å²	111	59.5 Å²	59.5	58%	0.581	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	116.4	174.2	-69.7	174.2	0	0	0	109.8
39	F	88.8	Confident	86.2	Confident	14 Å²	14	60.2 Å²	60.2	6%	0.061	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.9	172.6	178.3	-96.9	0	0	0	108.5	F35 Q37 G41 I43 V57 S61 A62 Y65 V90 Q91	F35-F39 HydrophobicContact CB-CB 4.34Å; F35-F39 HydrophobicContact CD1-CB 4.24Å; F35-F39 HydrophobicContact CD1-CD2 4.12Å; F35-F39 HydrophobicContact CD1-CG 4.41Å; F35-F39 HydrophobicContact CD2-CB 3.53Å; F35-F39 HydrophobicContact CD2-CD2 4.49Å; F35-F39 HydrophobicContact CD2-CG 4Å; F35-F39 HydrophobicContact CE1-CB 4.45Å; F35-F39 AromaticContact CE1-CD2 3.71Å; F35-F39 HydrophobicContact CE1-CD2 3.71Å; F35-F39 HydrophobicContact CE1-CE2 4.17Å; F35-F39 HydrophobicContact CE1-CG 4.15Å; F35-F39 HydrophobicContact CE2-CB 3.78Å; F35-F39 HydrophobicContact CE2-CD1 4.03Å; F35-F39 HydrophobicContact CE2-CD2 4.12Å; F35-F39 AromaticContact CE2-CG 3.71Å; F35-F39 HydrophobicContact CE2-CG 3.71Å; F35-F39 HydrophobicContact CG-CB 3.78Å; F35-F39 HydrophobicContact CG-CD2 4.48Å; F35-F39 HydrophobicContact CG-CG 4.34Å; F35-F39 HydrophobicContact CZ-CB 4.23Å; F35-F39 HydrophobicContact CZ-CD1 4.21Å; F35-F39 AromaticContact CZ-CD2 3.71Å; F35-F39 HydrophobicContact CZ-CD2 3.71Å; F35-F39 HydrophobicContact CZ-CE2 4.05Å; F35-F39 AromaticContact CZ-CG 3.79Å; F35-F39 HydrophobicContact CZ-CG 3.79Å; F35-F39 HydrophobicContact CZ-CZ 4.42Å; Q37-F39 PolarHBondContact O-N 2.91Å; Q37-F39 VanDerWaalsContact O-N 3.1Å; F39-G41 WeakPolarHBondContact CE1-O 3.04Å; F39-G41 VanDerWaalsContact CZ-C 3.48Å; F39-G41 VanDerWaalsContact CZ-CA 3.43Å; F39-I43 HydrophobicContact CE1-CD1 4.1Å; F39-I43 HydrophobicContact CE1-CG1 3.77Å; F39-I43 HydrophobicContact CZ-CD1 4.41Å; F39-I43 HydrophobicContact CZ-CG1 3.87Å; F39-V57 HydrophobicContact CD1-CG1 4.28Å; F39-V57 HydrophobicContact CE1-CG1 4.01Å; F39-S61 WeakPolarHBondContact O-CA 3.48Å; F39-A62 PolarHBondContact N-O 2.92Å; F39-A62 PolarHBondContact O-N 2.61Å; F39-Y65 HydrophobicContact CB-CE2 4.21Å; F39-Y65 AromaticContact CD1-CE2 3.71Å; F39-Y65 HydrophobicContact CD1-CE2 3.71Å; F39-Y65 HydrophobicContact CG-CE2 4.39Å; F39-Y65 PolarHBondContact O-OH 3.26Å; F39-V90 HydrophobicContact CD2-CG1 4.47Å; F39-V90 HydrophobicContact CE2-CG1 3.6Å; F39-V90 HydrophobicContact CZ-CG1 3.85Å; F39-Q91 WeakPolarHBondContact CZ-O 3.22Å
40	R	90.8	Very high	87	Confident	167 Å²	167	62 Å²	62	63%	0.63	34%	0.337	S	S	*	.			trans	-126.7	15.2	178.8	-68.7	-174.6	168.9	-172.3	-2.9	112.7	T60 S61	R40-T60 WeakPolarHBondContact CA-O 3.29Å; R40-S61 PolarHBondContact NE-OG 2.69Å
41	G	92.9	Very high	88	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.317	C	S	.	.	S	Bend	trans	-90.6	-155.5	-176	0	0	0	0	0	112.6	F39 E59 Q91 R92	F39-G41 WeakPolarHBondContact CE1-O 3.04Å; F39-G41 VanDerWaalsContact CZ-C 3.48Å; F39-G41 VanDerWaalsContact CZ-CA 3.43Å; G41-E59 PolarHBondContact O-N 2.79Å; G41-Q91 CarbonylContact C-O 3.43Å; G41-Q91 WeakPolarHBondContact CA-O 3.39Å; G41-R92 VanDerWaalsContact CA-O 3.25Å; G41-R92 WeakPolarHBondContact CA-O 3.46Å
42	V	94.5	Very high	88.8	Confident	5 Å²	5	60.2 Å²	60.2	3%	0.03	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.4	177.7	-57.8	0	0	0	0	110.4	Y44 Y49 V57 N58 E59 Q91 P94	V42-Y44 HydrophobicContact CB-CD1 4.46Å; V42-Y44 HydrophobicContact CG2-CD1 3.87Å; V42-Y44 HydrophobicContact CG2-CE1 3.8Å; V42-Y49 HydrophobicContact CG2-CE2 4.31Å; V42-V57 CarbonylContact C-O 3.47Å; V42-V57 VanDerWaalsContact CA-O 3.26Å; V42-V57 WeakPolarHBondContact CA-O 3.47Å; V42-N58 WeakPolarHBondContact CG1-OD1 3.49Å; V42-E59 HydrophobicContact CG1-CG 4.14Å; V42-Q91 HydrophobicContact CG2-CB 3.84Å; V42-Q91 HydrophobicContact CG2-CG 4.1Å; V42-Q91 PolarHBondContact N-O 2.93Å; V42-Q91 PolarHBondContact O-N 2.87Å; V42-P94 HydrophobicContact CG1-CB 3.89Å; V42-P94 HydrophobicContact CG1-CG 4.3Å
43	I	93.9	Very high	89.3	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.1	174.8	-55.2	-179.4	0	0	0	108.2	I33 F35 F39 Y56 V57 F67 I89 V90	I33-I43 HydrophobicContact CD1-CD1 4.44Å; I33-I43 HydrophobicContact CG2-CD1 3.89Å; F35-I43 HydrophobicContact CE2-CD1 4.26Å; F35-I43 HydrophobicContact CZ-CD1 4.03Å; F39-I43 HydrophobicContact CE1-CD1 4.1Å; F39-I43 HydrophobicContact CE1-CG1 3.77Å; F39-I43 HydrophobicContact CZ-CD1 4.41Å; F39-I43 HydrophobicContact CZ-CG1 3.87Å; I43-Y56 HydrophobicContact CG2-CD2 4.46Å; I43-Y56 PolarHBondContact O-N 3.04Å; I43-V57 HydrophobicContact CB-CB 3.86Å; I43-V57 HydrophobicContact CB-CG2 4.07Å; I43-V57 HydrophobicContact CD1-CB 4.12Å; I43-V57 HydrophobicContact CD1-CG2 3.79Å; I43-V57 HydrophobicContact CG1-CB 3.88Å; I43-V57 HydrophobicContact CG1-CG2 4.08Å; I43-V57 PolarHBondContact N-O 2.8Å; I43-V57 PolarHBondContact O-N 2.69Å; I43-F67 HydrophobicContact CD1-CE1 4.33Å; I43-F67 HydrophobicContact CG2-CE1 4.35Å; I43-F67 HydrophobicContact CG2-CZ 3.92Å; I43-I89 WeakPolarHBondContact CA-O 3.05Å; I43-V90 HydrophobicContact CD1-CG2 4.42Å; I43-V90 HydrophobicContact CG1-CG1 4.34Å; I43-V90 HydrophobicContact CG1-CG2 4.32Å; I43-V90 HydrophobicContact CG2-CG2 4.4Å
44	Y	93.7	Very high	89.9	Confident	13 Å²	13	66.4 Å²	66.4	5%	0.051	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	163	-175.5	60.6	-83.1	0	0	0	112	V42 Y49 C54 L88 I89 Q91	V42-Y44 HydrophobicContact CB-CD1 4.46Å; V42-Y44 HydrophobicContact CG2-CD1 3.87Å; V42-Y44 HydrophobicContact CG2-CE1 3.8Å; Y44-Y49 HydrophobicContact CD1-CD2 4.3Å; Y44-Y49 AromaticContact CE1-CD2 3.72Å; Y44-Y49 HydrophobicContact CE1-CD2 3.72Å; Y44-Y49 HydrophobicContact CE1-CE2 4.5Å; Y44-Y49 HydrophobicContact CE2-CD2 4.21Å; Y44-Y49 HydrophobicContact CE2-CG 4.43Å; Y44-Y49 AromaticContact CZ-CD2 3.66Å; Y44-C54 CarbonylContact C-O 3.58Å; Y44-C54 WeakPolarHBondContact CA-O 3.24Å; Y44-C54 WeakPolarHBondContact CB-O 3.46Å; Y44-L88 CarbonylContact O-C 3.48Å; Y44-L88 WeakPolarHBondContact O-CA 3.32Å; Y44-I89 HydrophobicContact CD1-CB 4.37Å; Y44-I89 HydrophobicContact CD2-CB 4.34Å; Y44-I89 HydrophobicContact CE1-CB 3.92Å; Y44-I89 HydrophobicContact CE1-CG2 3.73Å; Y44-I89 HydrophobicContact CE2-CB 3.88Å; Y44-I89 HydrophobicContact CE2-CG1 4.02Å; Y44-I89 HydrophobicContact CE2-CG2 4.27Å; Y44-I89 PolarHBondContact N-O 3.19Å; Y44-I89 VanDerWaalsContact N-O 3.13Å; Y44-I89 PolarHBondContact O-N 3.09Å; Y44-Q91 HydrophobicContact CE1-CB 4.07Å; Y44-Q91 VanDerWaalsContact CE1-OE1 3.3Å; Y44-Q91 PolarHBondContact OH-OE1 3.1Å
45	S	92.3	Very high	90.4	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	137.1	174.1	-51.9	0	0	0	0	111.4	G47 H48 C54 Y56 C74 H86 N87	S45-G47 PolarHBondContact O-N 2.99Å; S45-H48 WeakPolarHBondContact O-CA 3.39Å; S45-H48 WeakPolarHBondContact O-CB 3.12Å; S45-H48 PolarHBondContact O-N 2.67Å; S45-C54 PolarHBondContact N-O 2.82Å; S45-Y56 WeakPolarHBondContact OG-CE2 3.36Å; S45-Y56 PolarHBondContact OG-OH 2.79Å; S45-C74 WeakPolarHBondContact OG-CB 3.05Å; S45-H86 WeakPolarHBondContact CB-NE2 3.42Å; S45-H86 PolarHBondContact OG-CE1 2.76Å; S45-H86 PolarHBondContact OG-NE2 2.87Å; S45-N87 WeakPolarHBondContact CA-O 3.32Å
46	D	89.7	Confident	90.9	Very high	42 Å²	42	64 Å²	64	23%	0.225	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	133.5	179.7	179.9	21	0	0	0	111.8	H48 R75 N87 I89 L103	D46-H48 VanDerWaalsContact C-N 3.3Å; D46-H48 PolarHBondContact O-N 2.6Å; D46-H48 PolarHBondContact O-ND1 2.94Å; D46-R75 VanDerWaalsContact O-CZ 3.24Å; D46-R75 PolarHBondContact O-NH1 3.25Å; D46-R75 IonicContact OD2-CZ 3.75Å; D46-R75 IonicContact OD2-NH1 3.05Å; D46-R75 IonicContact OD2-NH2 3.88Å; D46-R75 PolarHBondContact OD2-NH2 3.03Å; D46-N87 HydrophobicContact CB-CB 3.73Å; D46-N87 PolarHBondContact N-O 2.62Å; D46-I89 HydrophobicContact CB-CD1 4.38Å; D46-I89 HydrophobicContact CB-CG1 4.02Å; D46-L103 HydrophobicContact CB-CD1 4.16Å
47	G	88.8	Confident	91.4	Very high	58 Å²	58	59.4 Å²	59.4	60%	0.598	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	6.6	-172.7	0	0	0	0	0	116	S45	S45-G47 PolarHBondContact O-N 2.99Å
48	H	92.4	Very high	91.9	Very high	44 Å²	44	56.8 Å²	56.8	20%	0.204	30%	0.297	C	S	.	.			trans	-121.4	29.1	-176.3	-62	63.8	0	0	0	113.4	S45 D46 G50 N51 C54	S45-H48 WeakPolarHBondContact O-CA 3.39Å; S45-H48 WeakPolarHBondContact O-CB 3.12Å; S45-H48 PolarHBondContact O-N 2.67Å; D46-H48 VanDerWaalsContact C-N 3.3Å; D46-H48 PolarHBondContact O-N 2.6Å; D46-H48 PolarHBondContact O-ND1 2.94Å; H48-G50 PolarHBondContact O-N 2.96Å; H48-N51 HydrophobicContact CB-CB 4.28Å; H48-N51 WeakPolarHBondContact O-CB 3.38Å; H48-N51 PolarHBondContact O-N 3.28Å; H48-N51 VanDerWaalsContact O-N 3.1Å; H48-C54 HydrophobicContact CB-CB 3.56Å; H48-C54 VanDerWaalsContact CD2-SG 3.51Å
49	Y	91.4	Very high	92.1	Very high	135 Å²	135	57 Å²	57	53%	0.529	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	134.4	175.6	179.9	-96.7	0	0	0	110.9	V42 Y44 N51 P94	V42-Y49 HydrophobicContact CG2-CE2 4.31Å; Y44-Y49 HydrophobicContact CD1-CD2 4.3Å; Y44-Y49 AromaticContact CE1-CD2 3.72Å; Y44-Y49 HydrophobicContact CE1-CD2 3.72Å; Y44-Y49 HydrophobicContact CE1-CE2 4.5Å; Y44-Y49 HydrophobicContact CE2-CD2 4.21Å; Y44-Y49 HydrophobicContact CE2-CG 4.43Å; Y44-Y49 AromaticContact CZ-CD2 3.66Å; Y49-N51 PolarHBondContact O-N 2.79Å; Y49-P94 PolarHBondContact OH-O 2.76Å
50	G	89.7	Confident	92.2	Very high	59 Å²	59	59.7 Å²	59.7	61%	0.608	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	-5.2	-179.4	0	0	0	0	0	115.6	H48 P52	H48-G50 PolarHBondContact O-N 2.96Å; G50-P52 VanDerWaalsContact O-CD 3.28Å; G50-P52 WeakPolarHBondContact O-CD 3.07Å
51	N	94.1	Very high	92.3	Very high	60 Å²	60	54.5 Å²	54.5	32%	0.321	30%	0.302	S	S	.	.			trans	-83.7	110.9	174.7	-176.7	-18.2	0	0	0	110.5	H48 Y49 R53 C54 T55	H48-N51 HydrophobicContact CB-CB 4.28Å; H48-N51 WeakPolarHBondContact O-CB 3.38Å; H48-N51 PolarHBondContact O-N 3.28Å; H48-N51 VanDerWaalsContact O-N 3.1Å; Y49-N51 PolarHBondContact O-N 2.79Å; N51-R53 PolarHBondContact O-N 2.98Å; N51-R53 VanDerWaalsContact O-N 3.08Å; N51-R53 WeakPolarHBondContact OD1-CB 3.24Å; N51-R53 PolarHBondContact OD1-N 2.87Å; N51-C54 HydrophobicContact CB-CB 4.34Å; N51-C54 CarbonylContact O-C 3.51Å; N51-C54 PolarHBondContact O-N 3.38Å; N51-T55 PolarHBondContact O-N 3.01Å; N51-T55 PolarHBondContact O-OG1 2.86Å; N51-T55 VanDerWaalsContact O-OG1 3.07Å
52	P	91.8	Very high	92.1	Very high	110 Å²	110	55.8 Å²	55.8	71%	0.714	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.4	-175.6	26.9	-35.6	0	0	0	114	G50 C54	G50-P52 VanDerWaalsContact O-CD 3.28Å; G50-P52 WeakPolarHBondContact O-CD 3.07Å; P52-C54 VanDerWaalsContact C-N 3.3Å
53	R	90.9	Very high	91.7	Very high	194 Å²	194	60.3 Å²	60.3	73%	0.732	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-19.7	174.4	-64.4	-170.3	179.1	176	1.4	113.2	N51 C74	N51-R53 PolarHBondContact O-N 2.98Å; N51-R53 VanDerWaalsContact O-N 3.08Å; N51-R53 WeakPolarHBondContact OD1-CB 3.24Å; N51-R53 PolarHBondContact OD1-N 2.87Å; R53-C74 PolarHBondContact O-SG 3.28Å
54	C	92.8	Very high	91.3	Very high	4 Å²	4	66.3 Å²	66.3	3%	0.027	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119	6.5	-176.1	-52.4	0	0	0	0	112.7	Y44 S45 H48 N51 P52 Y56 C74	Y44-C54 CarbonylContact C-O 3.58Å; Y44-C54 WeakPolarHBondContact CA-O 3.24Å; Y44-C54 WeakPolarHBondContact CB-O 3.46Å; S45-C54 PolarHBondContact N-O 2.82Å; H48-C54 HydrophobicContact CB-CB 3.56Å; H48-C54 VanDerWaalsContact CD2-SG 3.51Å; N51-C54 HydrophobicContact CB-CB 4.34Å; N51-C54 CarbonylContact O-C 3.51Å; N51-C54 PolarHBondContact O-N 3.38Å; P52-C54 VanDerWaalsContact C-N 3.3Å; C54-Y56 WeakPolarHBondContact O-CE2 3.41Å; C54-C74 WeakPolarHBondContact CA-SG 3.36Å; C54-C74 HydrophobicContact CB-CB 3.68Å; C54-C74 WeakPolarHBondContact CB-SG 3.5Å; C54-C74 WeakPolarHBondContact SG-CA 3.48Å; C54-C74 WeakPolarHBondContact SG-CB 3.46Å; C54-C74 CovalentContact SG-SG 2.03Å; C54-C74 PolarHBondContact SG-SG 2.82Å
55	T	94.9	Very high	90.7	Very high	35 Å²	35	66.9 Å²	66.9	22%	0.215	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.6	172.2	-60.4	0	0	0	0	108.8	N51 V57 N58	N51-T55 PolarHBondContact O-N 3.01Å; N51-T55 PolarHBondContact O-OG1 2.86Å; N51-T55 VanDerWaalsContact O-OG1 3.07Å; T55-V57 WeakPolarHBondContact CG2-O 3.43Å; T55-N58 HydrophobicContact CG2-CB 4.09Å
56	Y	91.7	Very high	90.3	Very high	40 Å²	40	71.9 Å²	71.9	16%	0.157	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-27.7	-173.3	-51.8	-61.4	0	0	0	113.1	I43 S45 C54 F67 I69 L88	I43-Y56 HydrophobicContact CG2-CD2 4.46Å; I43-Y56 PolarHBondContact O-N 3.04Å; S45-Y56 WeakPolarHBondContact OG-CE2 3.36Å; S45-Y56 PolarHBondContact OG-OH 2.79Å; C54-Y56 WeakPolarHBondContact O-CE2 3.41Å; Y56-F67 VanDerWaalsContact CB-CD2 3.48Å; Y56-F67 AromaticContact CD1-CD2 3.98Å; Y56-F67 HydrophobicContact CD1-CD2 3.98Å; Y56-F67 AromaticContact CD2-CD2 3.94Å; Y56-F67 HydrophobicContact CD2-CD2 3.94Å; Y56-F67 AromaticContact CD2-CE2 3.76Å; Y56-F67 HydrophobicContact CD2-CE2 3.76Å; Y56-F67 HydrophobicContact CE2-CE2 4.48Å; Y56-F67 AromaticContact CG-CD2 3.51Å; Y56-F67 HydrophobicContact CG-CD2 3.51Å; Y56-F67 AromaticContact CG-CE2 3.82Å; Y56-F67 HydrophobicContact CG-CE2 3.82Å; Y56-F67 HydrophobicContact CG-CG 4.12Å; Y56-I69 HydrophobicContact CE1-CG1 4.44Å; Y56-I69 HydrophobicContact CE2-CG1 4.19Å; Y56-L88 HydrophobicContact CD2-CD2 3.81Å; Y56-L88 HydrophobicContact CE2-CD2 3.41Å; Y56-L88 VanDerWaalsContact CE2-CD2 3.41Å
57	V	93.4	Very high	90	Very high	4 Å²	4	70.8 Å²	70.8	2%	0.024	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	131.3	174	179.2	0	0	0	0	107.5	F39 V42 I43 T55 Y65 F67	F39-V57 HydrophobicContact CD1-CG1 4.28Å; F39-V57 HydrophobicContact CE1-CG1 4.01Å; V42-V57 CarbonylContact C-O 3.47Å; V42-V57 VanDerWaalsContact CA-O 3.26Å; V42-V57 WeakPolarHBondContact CA-O 3.47Å; I43-V57 HydrophobicContact CB-CB 3.86Å; I43-V57 HydrophobicContact CB-CG2 4.07Å; I43-V57 HydrophobicContact CD1-CB 4.12Å; I43-V57 HydrophobicContact CD1-CG2 3.79Å; I43-V57 HydrophobicContact CG1-CB 3.88Å; I43-V57 HydrophobicContact CG1-CG2 4.08Å; I43-V57 PolarHBondContact N-O 2.8Å; I43-V57 PolarHBondContact O-N 2.69Å; T55-V57 WeakPolarHBondContact CG2-O 3.43Å; V57-Y65 HydrophobicContact CB-CD1 4.42Å; V57-Y65 HydrophobicContact CG1-CD1 3.97Å; V57-Y65 HydrophobicContact CG1-CD2 4.3Å; V57-Y65 HydrophobicContact CG1-CE1 3.61Å; V57-Y65 HydrophobicContact CG1-CE2 3.97Å; V57-Y65 HydrophobicContact CG1-CG 4.27Å; V57-Y65 HydrophobicContact CG2-CD1 3.56Å; V57-Y65 HydrophobicContact CG2-CD2 4.03Å; V57-Y65 HydrophobicContact CG2-CE1 4.1Å; V57-Y65 HydrophobicContact CG2-CG 3.48Å; V57-Y65 VanDerWaalsContact CG2-CG 3.48Å; V57-F67 HydrophobicContact CG2-CD1 4.33Å; V57-F67 HydrophobicContact CG2-CE1 4.49Å
58	N	93.8	Very high	89.5	Confident	97 Å²	97	69.4 Å²	69.4	52%	0.519	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	99.2	179.8	-168.3	34.4	0	0	0	111.2	V42 T55 T60	V42-N58 WeakPolarHBondContact CG1-OD1 3.49Å; T55-N58 HydrophobicContact CG2-CB 4.09Å; N58-T60 PolarHBondContact O-N 2.73Å
59	E	91.7	Very high	89	Confident	116 Å²	116	67.5 Å²	67.5	54%	0.542	36%	0.355	S	S	.	.	S	Bend	trans	56.4	14.8	170.5	-53.5	-168.7	-106.4	0	0	115.9	G41 V42 P94	G41-E59 PolarHBondContact O-N 2.79Å; V42-E59 HydrophobicContact CG1-CG 4.14Å; E59-P94 HydrophobicContact CG-CB 3.71Å; E59-P94 HydrophobicContact CG-CG 3.49Å; E59-P94 VanDerWaalsContact CG-CG 3.49Å
60	T	91.5	Very high	88.3	Confident	71 Å²	71	61.7 Å²	61.7	44%	0.436	33%	0.334	S	S	.	.			trans	-76.5	156.9	171.9	55.1	0	0	0	0	109.5	R40 N58 Y65	R40-T60 WeakPolarHBondContact CA-O 3.29Å; N58-T60 PolarHBondContact O-N 2.73Å; T60-Y65 PolarHBondContact O-OH 3.45Å; T60-Y65 WeakPolarHBondContact OG1-CE1 3.1Å; T60-Y65 PolarHBondContact OG1-OH 2.05Å
61	S	92.4	Very high	87.5	Confident	58 Å²	58	59.6 Å²	59.6	41%	0.406	31%	0.309	S	S	.	.			trans	-111.2	92.1	-177.2	-176.9	0	0	0	0	111	F39 R40	F39-S61 WeakPolarHBondContact O-CA 3.48Å; R40-S61 PolarHBondContact NE-OG 2.69Å
62	A	88.5	Confident	86.6	Confident	27 Å²	27	62.3 Å²	62.3	22%	0.223	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	160.6	175.6	0	0	0	0	0	112	F39 Y65	F39-A62 PolarHBondContact N-O 2.92Å; F39-A62 PolarHBondContact O-N 2.61Å; A62-Y65 HydrophobicContact CB-CE1 3.84Å; A62-Y65 HydrophobicContact CB-CE2 4.03Å; A62-Y65 PolarHBondContact N-OH 2.86Å
63	N	86.2	Confident	86.2	Confident	99 Å²	99	61.9 Å²	61.9	53%	0.529	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-6.9	172	62.7	-9.7	0	0	0	112.4	S34 F35	S34-N63 CarbonylContact C-O 3.54Å; S34-N63 VanDerWaalsContact CA-O 3.25Å; S34-N63 WeakPolarHBondContact CA-O 3.04Å; F35-N63 PolarHBondContact N-O 2.92Å
64	R	84.8	Confident	86	Confident	127 Å²	127	53.1 Å²	53.1	48%	0.479	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	139.5	179.7	177.7	178.8	176.1	116.3	-0.4	110.4	S32 I33 D66	S32-R64 PolarHBondContact OG-NE 2.66Å; S32-R64 PolarHBondContact OG-NH2 3.42Å; I33-R64 VanDerWaalsContact O-CA 3.29Å; I33-R64 WeakPolarHBondContact O-CA 3.47Å; R64-D66 IonicContact CZ-OD1 2.69Å; R64-D66 IonicContact CZ-OD2 3.7Å; R64-D66 IonicContact NE-OD1 2.72Å; R64-D66 IonicContact NE-OD2 3.55Å; R64-D66 PolarHBondContact NE-OD2 3.2Å; R64-D66 IonicContact NH2-OD1 3.08Å; R64-D66 PolarHBondContact NH2-OD1 2.89Å; R64-D66 IonicContact NH2-OD2 3.03Å
65	Y	82.8	Confident	85.5	Confident	25 Å²	25	59.5 Å²	59.5	10%	0.098	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.2	172.3	-63.3	-82.2	0	0	0	110.7	S32 I33 F35 F39 V57 T60 A62	S32-Y65 WeakPolarHBondContact CA-O 3.1Å; I33-Y65 HydrophobicContact CG2-CD2 4.42Å; I33-Y65 PolarHBondContact N-O 2.92Å; I33-Y65 PolarHBondContact O-N 2.68Å; F35-Y65 HydrophobicContact CD2-CD2 4.4Å; F35-Y65 HydrophobicContact CD2-CE2 4.49Å; F35-Y65 AromaticContact CE2-CD2 3.96Å; F35-Y65 HydrophobicContact CE2-CD2 3.96Å; F35-Y65 HydrophobicContact CE2-CE2 4.22Å; F39-Y65 HydrophobicContact CB-CE2 4.21Å; F39-Y65 AromaticContact CD1-CE2 3.71Å; F39-Y65 HydrophobicContact CD1-CE2 3.71Å; F39-Y65 HydrophobicContact CG-CE2 4.39Å; F39-Y65 PolarHBondContact O-OH 3.26Å; V57-Y65 HydrophobicContact CB-CD1 4.42Å; V57-Y65 HydrophobicContact CG1-CD1 3.97Å; V57-Y65 HydrophobicContact CG1-CD2 4.3Å; V57-Y65 HydrophobicContact CG1-CE1 3.61Å; V57-Y65 HydrophobicContact CG1-CE2 3.97Å; V57-Y65 HydrophobicContact CG1-CG 4.27Å; V57-Y65 HydrophobicContact CG2-CD1 3.56Å; V57-Y65 HydrophobicContact CG2-CD2 4.03Å; V57-Y65 HydrophobicContact CG2-CE1 4.1Å; V57-Y65 HydrophobicContact CG2-CG 3.48Å; V57-Y65 VanDerWaalsContact CG2-CG 3.48Å; T60-Y65 PolarHBondContact O-OH 3.45Å; T60-Y65 WeakPolarHBondContact OG1-CE1 3.1Å; T60-Y65 PolarHBondContact OG1-OH 2.05Å; A62-Y65 HydrophobicContact CB-CE1 3.84Å; A62-Y65 HydrophobicContact CB-CE2 4.03Å; A62-Y65 PolarHBondContact N-OH 2.86Å
66	D	82.6	Confident	84.4	Confident	104 Å²	104	58.4 Å²	58.4	56%	0.556	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	120	172.6	-61.8	-81.2	0	0	0	107.1	F31 S32 R64	F31-D66 WeakPolarHBondContact O-CA 3.48Å; S32-D66 WeakPolarHBondContact CB-OD1 3.38Å; S32-D66 PolarHBondContact OG-OD1 2.94Å; R64-D66 IonicContact CZ-OD1 2.69Å; R64-D66 IonicContact CZ-OD2 3.7Å; R64-D66 IonicContact NE-OD1 2.72Å; R64-D66 IonicContact NE-OD2 3.55Å; R64-D66 PolarHBondContact NE-OD2 3.2Å; R64-D66 IonicContact NH2-OD1 3.08Å; R64-D66 PolarHBondContact NH2-OD1 2.89Å; R64-D66 IonicContact NH2-OD2 3.03Å
67	F	82.8	Confident	83.3	Confident	19 Å²	19	58.2 Å²	58.2	8%	0.083	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	168	-176.8	56.5	-95.4	0	0	0	111.2	H30 F31 I33 I43 Y56 V57 I69 L88	H30-F67 WeakPolarHBondContact CA-O 3.49Å; F31-F67 HydrophobicContact CB-CD2 4.3Å; F31-F67 HydrophobicContact CB-CE2 3.98Å; F31-F67 HydrophobicContact CB-CZ 4.31Å; F31-F67 AromaticContact CD1-CE1 3.94Å; F31-F67 HydrophobicContact CD1-CE1 3.94Å; F31-F67 AromaticContact CD1-CE2 3.88Å; F31-F67 HydrophobicContact CD1-CE2 3.88Å; F31-F67 AromaticContact CD1-CZ 3.39Å; F31-F67 HydrophobicContact CD1-CZ 3.39Å; F31-F67 HydrophobicContact CE1-CZ 4.11Å; F31-F67 HydrophobicContact CG-CE2 4.32Å; F31-F67 HydrophobicContact CG-CZ 4.26Å; F31-F67 PolarHBondContact N-O 3.15Å; F31-F67 PolarHBondContact O-N 3.15Å; I33-F67 HydrophobicContact CG2-CE1 3.88Å; I43-F67 HydrophobicContact CD1-CE1 4.33Å; I43-F67 HydrophobicContact CG2-CE1 4.35Å; I43-F67 HydrophobicContact CG2-CZ 3.92Å; Y56-F67 VanDerWaalsContact CB-CD2 3.48Å; Y56-F67 AromaticContact CD1-CD2 3.98Å; Y56-F67 HydrophobicContact CD1-CD2 3.98Å; Y56-F67 AromaticContact CD2-CD2 3.94Å; Y56-F67 HydrophobicContact CD2-CD2 3.94Å; Y56-F67 AromaticContact CD2-CE2 3.76Å; Y56-F67 HydrophobicContact CD2-CE2 3.76Å; Y56-F67 HydrophobicContact CE2-CE2 4.48Å; Y56-F67 AromaticContact CG-CD2 3.51Å; Y56-F67 HydrophobicContact CG-CD2 3.51Å; Y56-F67 AromaticContact CG-CE2 3.82Å; Y56-F67 HydrophobicContact CG-CE2 3.82Å; Y56-F67 HydrophobicContact CG-CG 4.12Å; V57-F67 HydrophobicContact CG2-CD1 4.33Å; V57-F67 HydrophobicContact CG2-CE1 4.49Å; F67-I69 HydrophobicContact CD2-CG1 4.31Å; F67-I69 HydrophobicContact CE2-CD1 4.4Å; F67-I69 HydrophobicContact CE2-CG1 4.16Å; F67-L88 HydrophobicContact CE2-CD1 3.87Å; F67-L88 HydrophobicContact CZ-CD1 3.82Å
68	A	79.1	Confident	82.1	Confident	30 Å²	30	66 Å²	66	25%	0.248	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.7	-176.3	0	0	0	0	0	111	K28 V29	K28-A68 HydrophobicContact CB-CB 4.01Å; K28-A68 HydrophobicContact CD-CB 4.07Å; V29-A68 CarbonylContact O-C 3.57Å; V29-A68 WeakPolarHBondContact O-CA 3.47Å
69	I	81.8	Confident	80.8	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.015	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	120.3	179.4	-60.6	167.3	0	0	0	108.5	K28 V29 F31 Y56 F67 I71 H86 L88 I106	K28-I69 CarbonylContact C-O 3.51Å; K28-I69 WeakPolarHBondContact CA-O 3.3Å; V29-I69 PolarHBondContact N-O 2.86Å; V29-I69 PolarHBondContact O-N 3.4Å; F31-I69 HydrophobicContact CB-CD1 4.44Å; Y56-I69 HydrophobicContact CE1-CG1 4.44Å; Y56-I69 HydrophobicContact CE2-CG1 4.19Å; F67-I69 HydrophobicContact CD2-CG1 4.31Å; F67-I69 HydrophobicContact CE2-CD1 4.4Å; F67-I69 HydrophobicContact CE2-CG1 4.16Å; I69-I71 PolarHBondContact O-N 3.18Å; I69-H86 HydrophobicContact CG2-CB 4.4Å; I69-H86 VanDerWaalsContact CG2-CE1 3.47Å; I69-H86 WeakPolarHBondContact CG2-CE1 3.31Å; I69-H86 WeakPolarHBondContact CG2-ND1 3.5Å; I69-L88 HydrophobicContact CD1-CD1 4.14Å; I69-L88 HydrophobicContact CD1-CD2 4.06Å; I69-L88 HydrophobicContact CD1-CG 4.33Å; I69-L88 HydrophobicContact CG1-CD2 4.46Å; I69-I106 HydrophobicContact CD1-CD1 3.69Å
70	P	76.7	Confident	79.6	Confident	14 Å²	14	69.7 Å²	69.7	9%	0.091	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	132.4	175	28.9	-33.9	0	0	0	111.7	Q27 E73 T76	Q27-P70 CarbonylContact O-C 3.5Å; Q27-P70 WeakPolarHBondContact O-CA 3.06Å; P70-E73 HydrophobicContact CB-CB 4.01Å; P70-E73 HydrophobicContact CB-CG 4.42Å; P70-E73 HydrophobicContact CG-CB 3.9Å; P70-T76 PolarHBondContact O-OG1 3.31Å; P70-T76 VanDerWaalsContact O-OG1 3.04Å
71	I	73.1	Confident	78.3	Confident	15 Å²	15	70.9 Å²	70.9	8%	0.077	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	137.3	173.9	-61.4	165.9	0	0	0	108	M1 L26 Q27 V29 I69 E73 V84	M1-I71 HydrophobicContact CE-CD1 3.89Å; L26-I71 WeakPolarHBondContact O-CD1 3.24Å; Q27-I71 PolarHBondContact O-N 2.98Å; V29-I71 HydrophobicContact CG2-CD1 3.88Å; V29-I71 HydrophobicContact CG2-CG1 3.87Å; I69-I71 PolarHBondContact O-N 3.18Å; I71-E73 VanDerWaalsContact C-N 3.25Å; I71-E73 PolarHBondContact O-N 3Å; I71-V84 HydrophobicContact CG2-CG2 4.28Å
72	N	75.6	Confident	77.1	Confident	116 Å²	116	68.5 Å²	68.5	62%	0.62	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	9.4	-174.5	-46.8	-45.2	0	0	0	115.9
73	E	82.3	Confident	76.1	Confident	101 Å²	101	67.6 Å²	67.6	47%	0.472	33%	0.331	S	S	.	.	S	Bend	trans	-123.3	170.6	170	-63.5	-178.1	-165.6	0	0	110	P70 I71 R75 T76	P70-E73 HydrophobicContact CB-CB 4.01Å; P70-E73 HydrophobicContact CB-CG 4.42Å; P70-E73 HydrophobicContact CG-CB 3.9Å; I71-E73 VanDerWaalsContact C-N 3.25Å; I71-E73 PolarHBondContact O-N 3Å; E73-R75 VanDerWaalsContact C-N 3.29Å; E73-R75 PolarHBondContact O-N 3.12Å; E73-T76 WeakPolarHBondContact O-CB 3.44Å; E73-T76 PolarHBondContact O-N 2.75Å; E73-T76 PolarHBondContact O-OG1 2.99Å
74	C	88.3	Confident	75.4	Confident	11 Å²	11	63 Å²	63	7%	0.074	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	40.6	172.5	-56.2	0	0	0	0	114.5	S45 R53 C54 T76 H86	S45-C74 WeakPolarHBondContact OG-CB 3.05Å; R53-C74 PolarHBondContact O-SG 3.28Å; C54-C74 WeakPolarHBondContact CA-SG 3.36Å; C54-C74 HydrophobicContact CB-CB 3.68Å; C54-C74 WeakPolarHBondContact CB-SG 3.5Å; C54-C74 WeakPolarHBondContact SG-CA 3.48Å; C54-C74 WeakPolarHBondContact SG-CB 3.46Å; C54-C74 CovalentContact SG-SG 2.03Å; C54-C74 PolarHBondContact SG-SG 2.82Å; C74-T76 PolarHBondContact O-N 3.35Å; C74-H86 PolarHBondContact O-CE1 3.38Å; C74-H86 VanDerWaalsContact O-CE1 3.27Å
75	R	81.1	Confident	75.1	Confident	138 Å²	138	60.6 Å²	60.6	52%	0.521	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	18.8	-175.6	-137.7	170.1	65.5	-179	7	115.5	D46 E73 G77	D46-R75 VanDerWaalsContact O-CZ 3.24Å; D46-R75 PolarHBondContact O-NH1 3.25Å; D46-R75 IonicContact OD2-CZ 3.75Å; D46-R75 IonicContact OD2-NH1 3.05Å; D46-R75 IonicContact OD2-NH2 3.88Å; D46-R75 PolarHBondContact OD2-NH2 3.03Å; E73-R75 VanDerWaalsContact C-N 3.29Å; E73-R75 PolarHBondContact O-N 3.12Å; R75-G77 PolarHBondContact O-N 2.89Å; R75-G77 VanDerWaalsContact O-N 3.11Å
76	T	71.8	Confident	75	Confident	11 Å²	11	59.7 Å²	59.7	7%	0.067	30%	0.297	C	S	.	.			trans	-70.1	104.4	173.3	-51.9	0	0	0	0	109.9	P70 E73 C74 V84 Q85 H86	P70-T76 PolarHBondContact O-OG1 3.31Å; P70-T76 VanDerWaalsContact O-OG1 3.04Å; E73-T76 WeakPolarHBondContact O-CB 3.44Å; E73-T76 PolarHBondContact O-N 2.75Å; E73-T76 PolarHBondContact O-OG1 2.99Å; C74-T76 PolarHBondContact O-N 3.35Å; T76-V84 HydrophobicContact CG2-CG1 3.33Å; T76-Q85 WeakPolarHBondContact CA-O 3.1Å; T76-H86 HydrophobicContact CG2-CB 4.46Å; T76-H86 PolarHBondContact OG1-CE1 2.83Å; T76-H86 PolarHBondContact OG1-ND1 2.74Å
77	G	69.9	Low	75.1	Confident	37 Å²	37	56.8 Å²	56.8	38%	0.381	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.6	179.6	0	0	0	0	0	110.9	R75 V84 Q85	R75-G77 PolarHBondContact O-N 2.89Å; R75-G77 VanDerWaalsContact O-N 3.11Å; G77-V84 WeakPolarHBondContact O-CA 3.34Å; G77-Q85 PolarHBondContact N-O 3.4Å; G77-Q85 VanDerWaalsContact N-O 3.17Å; G77-Q85 PolarHBondContact O-N 3.48Å
78	R	66.4	Low	75.3	Confident	168 Å²	168	55.9 Å²	55.9	63%	0.634	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	113.8	165.2	-170.2	175.7	-175.8	-155.9	-2.7	108.4	T83 V84	R78-T83 CarbonylContact C-O 3.47Å; R78-T83 WeakPolarHBondContact CA-O 3.08Å; R78-V84 HydrophobicContact CB-CG2 4.28Å; R78-V84 HydrophobicContact CG-CG2 4.05Å
79	Q	67.2	Low	75.9	Confident	81 Å²	81	55.5 Å²	55.5	38%	0.379	27%	0.271	S	S	.	.			trans	-71.8	158.1	173	-64.7	-168.3	15.2	0	0	110.9	N81 G82 T83	Q79-N81 WeakPolarHBondContact CB-OD1 3.36Å; Q79-N81 PolarHBondContact O-N 2.93Å; Q79-G82 WeakPolarHBondContact O-CA 3.32Å; Q79-G82 PolarHBondContact O-N 2.88Å; Q79-T83 PolarHBondContact N-O 3.05Å
80	E	66	Low	76.3	Confident	209 Å²	209	55.5 Å²	55.5	98%	0.977	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-35.7	178.9	-68.1	-173.4	167.1	0	0	113	G82	E80-G82 PolarHBondContact O-N 3.31Å; E80-G82 VanDerWaalsContact O-N 3.09Å
81	N	64.1	Low	76.9	Confident	96 Å²	96	55 Å²	55	51%	0.513	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-8.3	177.2	65.3	14.7	0	0	0	113.6	Q79 T83 P110	Q79-N81 WeakPolarHBondContact CB-OD1 3.36Å; Q79-N81 PolarHBondContact O-N 2.93Å; N81-T83 VanDerWaalsContact CG-OG1 3.31Å; N81-T83 PolarHBondContact ND2-OG1 3.09Å; N81-T83 WeakPolarHBondContact OD1-CA 3.44Å; N81-T83 WeakPolarHBondContact OD1-CB 3.36Å; N81-T83 PolarHBondContact OD1-N 3.4Å; N81-T83 PolarHBondContact OD1-OG1 2.84Å; N81-P110 VanDerWaalsContact O-CG 3.22Å; N81-P110 WeakPolarHBondContact O-CG 3.44Å
82	G	67.8	Low	77.5	Confident	8 Å²	8	60.4 Å²	60.4	8%	0.082	29%	0.287	C	S	.	.	S	Bend	trans	95	-2	-177.4	0	0	0	0	0	114.6	Q79 E80	Q79-G82 WeakPolarHBondContact O-CA 3.32Å; Q79-G82 PolarHBondContact O-N 2.88Å; E80-G82 PolarHBondContact O-N 3.31Å; E80-G82 VanDerWaalsContact O-N 3.09Å
83	T	67.3	Low	78.2	Confident	8 Å²	8	58 Å²	58	5%	0.049	27%	0.274	C	S	.	.			trans	-69.3	132.1	176.7	-55	0	0	0	0	110.1	R78 Q79 N81 Q85 I107 C108 L109 P110	R78-T83 CarbonylContact C-O 3.47Å; R78-T83 WeakPolarHBondContact CA-O 3.08Å; Q79-T83 PolarHBondContact N-O 3.05Å; N81-T83 VanDerWaalsContact CG-OG1 3.31Å; N81-T83 PolarHBondContact ND2-OG1 3.09Å; N81-T83 WeakPolarHBondContact OD1-CA 3.44Å; N81-T83 WeakPolarHBondContact OD1-CB 3.36Å; N81-T83 PolarHBondContact OD1-N 3.4Å; N81-T83 PolarHBondContact OD1-OG1 2.84Å; T83-Q85 HydrophobicContact CG2-CG 4.25Å; T83-I107 HydrophobicContact CG2-CG2 3.58Å; T83-C108 CarbonylContact C-O 3.54Å; T83-C108 VanDerWaalsContact CA-O 3.32Å; T83-C108 WeakPolarHBondContact CA-O 3.02Å; T83-C108 WeakPolarHBondContact CG2-O 3.25Å; T83-L109 HydrophobicContact CG2-CD2 4.13Å; T83-P110 WeakPolarHBondContact OG1-CD 3.09Å
84	V	71.7	Confident	78.5	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	127.8	174	171.8	0	0	0	0	108.4	M1 I71 T76 G77 R78 C108	M1-V84 HydrophobicContact CE-CG2 4.26Å; M1-V84 HydrophobicContact SD-CB 3.87Å; M1-V84 HydrophobicContact SD-CG2 3.52Å; M1-V84 VanDerWaalsContact SD-CG2 3.52Å; I71-V84 HydrophobicContact CG2-CG2 4.28Å; T76-V84 HydrophobicContact CG2-CG1 3.33Å; G77-V84 WeakPolarHBondContact O-CA 3.34Å; R78-V84 HydrophobicContact CB-CG2 4.28Å; R78-V84 HydrophobicContact CG-CG2 4.05Å; V84-C108 HydrophobicContact CB-CB 3.94Å; V84-C108 PolarHBondContact N-O 2.69Å; V84-C108 WeakPolarHBondContact O-CA 3.39Å; V84-C108 WeakPolarHBondContact O-CB 3.04Å; V84-C108 PolarHBondContact O-N 3.03Å
85	Q	78.7	Confident	78.5	Confident	76 Å²	76	62 Å²	62	36%	0.355	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.2	176.1	-65.4	-178.5	-43.2	0	0	110.1	T76 G77 T83 I106 I107	T76-Q85 WeakPolarHBondContact CA-O 3.1Å; G77-Q85 PolarHBondContact N-O 3.4Å; G77-Q85 VanDerWaalsContact N-O 3.17Å; G77-Q85 PolarHBondContact O-N 3.48Å; T83-Q85 HydrophobicContact CG2-CG 4.25Å; Q85-I106 WeakPolarHBondContact CA-O 3.31Å; Q85-I107 HydrophobicContact CG-CG1 4.35Å
86	H	81.6	Confident	78.8	Confident	7 Å²	7	60.1 Å²	60.1	3%	0.032	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	138.2	177.3	-166.5	85.7	0	0	0	111.2	S45 I69 C74 T76 L88 I106	S45-H86 WeakPolarHBondContact CB-NE2 3.42Å; S45-H86 PolarHBondContact OG-CE1 2.76Å; S45-H86 PolarHBondContact OG-NE2 2.87Å; I69-H86 HydrophobicContact CG2-CB 4.4Å; I69-H86 VanDerWaalsContact CG2-CE1 3.47Å; I69-H86 WeakPolarHBondContact CG2-CE1 3.31Å; I69-H86 WeakPolarHBondContact CG2-ND1 3.5Å; C74-H86 PolarHBondContact O-CE1 3.38Å; C74-H86 VanDerWaalsContact O-CE1 3.27Å; T76-H86 HydrophobicContact CG2-CB 4.46Å; T76-H86 PolarHBondContact OG1-CE1 2.83Å; T76-H86 PolarHBondContact OG1-ND1 2.74Å; H86-L88 VanDerWaalsContact CD2-CD2 3.44Å; H86-L88 WeakPolarHBondContact CD2-CD2 3.37Å; H86-L88 WeakPolarHBondContact NE2-CD2 3.41Å; H86-I106 HydrophobicContact CB-CB 4.44Å; H86-I106 PolarHBondContact N-O 2.84Å; H86-I106 WeakPolarHBondContact O-CA 3.23Å; H86-I106 VanDerWaalsContact O-CB 3.3Å; H86-I106 WeakPolarHBondContact O-CB 3.14Å; H86-I106 PolarHBondContact O-N 2.89Å
87	N	84.7	Confident	79.4	Confident	43 Å²	43	65.8 Å²	65.8	23%	0.23	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.8	-179.8	-67.5	-8.5	0	0	0	109.4	S45 D46 L103 L104 Y105	S45-N87 WeakPolarHBondContact CA-O 3.32Å; D46-N87 HydrophobicContact CB-CB 3.73Å; D46-N87 PolarHBondContact N-O 2.62Å; N87-L103 HydrophobicContact CB-CD1 3.92Å; N87-L104 CarbonylContact C-O 3.58Å; N87-L104 WeakPolarHBondContact CA-O 3.26Å; N87-Y105 VanDerWaalsContact OD1-CD1 3.25Å; N87-Y105 WeakPolarHBondContact OD1-CD1 3.2Å
88	L	87.2	Confident	80	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	142.6	175.8	-59.3	176	0	0	0	110.9	F31 Y44 Y56 F67 I69 H86 L103 L104 I106	F31-L88 HydrophobicContact CD1-CD1 4.18Å; F31-L88 HydrophobicContact CE1-CD1 4.12Å; Y44-L88 CarbonylContact O-C 3.48Å; Y44-L88 WeakPolarHBondContact O-CA 3.32Å; Y56-L88 HydrophobicContact CD2-CD2 3.81Å; Y56-L88 HydrophobicContact CE2-CD2 3.41Å; Y56-L88 VanDerWaalsContact CE2-CD2 3.41Å; F67-L88 HydrophobicContact CE2-CD1 3.87Å; F67-L88 HydrophobicContact CZ-CD1 3.82Å; I69-L88 HydrophobicContact CD1-CD1 4.14Å; I69-L88 HydrophobicContact CD1-CD2 4.06Å; I69-L88 HydrophobicContact CD1-CG 4.33Å; I69-L88 HydrophobicContact CG1-CD2 4.46Å; H86-L88 VanDerWaalsContact CD2-CD2 3.44Å; H86-L88 WeakPolarHBondContact CD2-CD2 3.37Å; H86-L88 WeakPolarHBondContact NE2-CD2 3.41Å; L88-L103 CarbonylContact O-C 3.58Å; L88-L103 WeakPolarHBondContact O-CA 3.38Å; L88-L103 WeakPolarHBondContact O-CD1 3.29Å; L88-L104 HydrophobicContact CB-CB 4.18Å; L88-L104 PolarHBondContact N-O 2.82Å; L88-L104 PolarHBondContact O-N 2.91Å; L88-I106 HydrophobicContact CD1-CD1 3.58Å; L88-I106 HydrophobicContact CG-CD1 3.91Å
89	I	89.8	Confident	80.8	Confident	22 Å²	22	62.9 Å²	62.9	11%	0.113	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.8	166.1	-59.6	-71.6	0	0	0	108.1	I43 Y44 D46 Q91 Q102 L103	I43-I89 WeakPolarHBondContact CA-O 3.05Å; Y44-I89 HydrophobicContact CD1-CB 4.37Å; Y44-I89 HydrophobicContact CD2-CB 4.34Å; Y44-I89 HydrophobicContact CE1-CB 3.92Å; Y44-I89 HydrophobicContact CE1-CG2 3.73Å; Y44-I89 HydrophobicContact CE2-CB 3.88Å; Y44-I89 HydrophobicContact CE2-CG1 4.02Å; Y44-I89 HydrophobicContact CE2-CG2 4.27Å; Y44-I89 PolarHBondContact N-O 3.19Å; Y44-I89 VanDerWaalsContact N-O 3.13Å; Y44-I89 PolarHBondContact O-N 3.09Å; D46-I89 HydrophobicContact CB-CD1 4.38Å; D46-I89 HydrophobicContact CB-CG1 4.02Å; I89-Q91 HydrophobicContact CG2-CB 4.07Å; I89-Q102 CarbonylContact C-O 3.58Å; I89-Q102 WeakPolarHBondContact CA-O 3.13Å; I89-L103 HydrophobicContact CD1-CB 4.2Å; I89-L103 HydrophobicContact CD1-CD1 3.74Å; I89-L103 HydrophobicContact CD1-CG 4.45Å
90	V	92.2	Very high	81.5	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.018	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	99.3	168.5	-178.5	0	0	0	0	107	I33 F35 F39 I43 D101 Q102 L104	I33-V90 HydrophobicContact CD1-CG2 3.95Å; F35-V90 HydrophobicContact CE1-CG1 3.81Å; F35-V90 HydrophobicContact CZ-CG1 3.81Å; F39-V90 HydrophobicContact CD2-CG1 4.47Å; F39-V90 HydrophobicContact CE2-CG1 3.6Å; F39-V90 HydrophobicContact CZ-CG1 3.85Å; I43-V90 HydrophobicContact CD1-CG2 4.42Å; I43-V90 HydrophobicContact CG1-CG1 4.34Å; I43-V90 HydrophobicContact CG1-CG2 4.32Å; I43-V90 HydrophobicContact CG2-CG2 4.4Å; V90-D101 WeakPolarHBondContact O-CA 3.38Å; V90-Q102 HydrophobicContact CB-CB 4.31Å; V90-Q102 PolarHBondContact N-O 3.34Å; V90-Q102 PolarHBondContact O-N 3.46Å; V90-L104 HydrophobicContact CG2-CD1 3.45Å; V90-L104 VanDerWaalsContact CG2-CD1 3.45Å; V90-L104 HydrophobicContact CG2-CG 4.4Å
91	Q	89.3	Confident	82.5	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.009	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.6	-176.1	172.1	176.9	-13.2	0	0	109	F39 G41 V42 Y44 I89 D93 I96 L97 D101	F39-Q91 WeakPolarHBondContact CZ-O 3.22Å; G41-Q91 CarbonylContact C-O 3.43Å; G41-Q91 WeakPolarHBondContact CA-O 3.39Å; V42-Q91 HydrophobicContact CG2-CB 3.84Å; V42-Q91 HydrophobicContact CG2-CG 4.1Å; V42-Q91 PolarHBondContact N-O 2.93Å; V42-Q91 PolarHBondContact O-N 2.87Å; Y44-Q91 HydrophobicContact CE1-CB 4.07Å; Y44-Q91 VanDerWaalsContact CE1-OE1 3.3Å; Y44-Q91 PolarHBondContact OH-OE1 3.1Å; I89-Q91 HydrophobicContact CG2-CB 4.07Å; Q91-D93 WeakPolarHBondContact CG-O 3.39Å; Q91-D93 PolarHBondContact NE2-O 2.77Å; Q91-I96 PolarHBondContact NE2-O 2.78Å; Q91-L97 HydrophobicContact CG-CD2 4.34Å; Q91-D101 VanDerWaalsContact CA-OD1 3.29Å; Q91-D101 WeakPolarHBondContact CA-OD1 3.12Å
92	R	85.7	Confident	83.5	Confident	129 Å²	129	55.2 Å²	55.2	49%	0.487	30%	0.295	S	S	.	.	S	Bend	trans	-76.6	-38.6	-173.4	-65.5	-171.2	-151.5	-157.3	8.2	112.9	G41 Q100 D101	G41-R92 VanDerWaalsContact CA-O 3.25Å; G41-R92 WeakPolarHBondContact CA-O 3.46Å; R92-Q100 PolarHBondContact NE-O 3.06Å; R92-Q100 VanDerWaalsContact NE-O 3.08Å; R92-Q100 PolarHBondContact NH2-O 2.99Å; R92-D101 PolarHBondContact N-OD1 2.86Å
93	D	88.8	Confident	84.2	Confident	66 Å²	66	57.1 Å²	57.1	35%	0.353	30%	0.303	S	S	.	.	S	Bend	trans	-102	118.9	176	-172.3	-63	0	0	0	109.5	Q91 K95 I96	Q91-D93 WeakPolarHBondContact CG-O 3.39Å; Q91-D93 PolarHBondContact NE2-O 2.77Å; D93-K95 PolarHBondContact O-N 2.86Å; D93-K95 WeakPolarHBondContact OD1-CA 3.45Å; D93-K95 WeakPolarHBondContact OD1-CB 3.48Å; D93-K95 PolarHBondContact OD1-N 3.49Å; D93-I96 HydrophobicContact CB-CD1 4.37Å; D93-I96 HydrophobicContact CB-CG1 3.59Å; D93-I96 VanDerWaalsContact CG-CG1 3.5Å; D93-I96 PolarHBondContact O-N 2.8Å; D93-I96 PolarHBondContact OD1-N 3.45Å
94	P	90	Very high	84.9	Confident	19 Å²	19	57.6 Å²	57.6	12%	0.123	31%	0.305	C	S	.	.	S	Bend	trans	-58	-23.8	-176.5	-25.6	35	0	0	0	115.3	V42 Y49 E59	V42-P94 HydrophobicContact CG1-CB 3.89Å; V42-P94 HydrophobicContact CG1-CG 4.3Å; Y49-P94 PolarHBondContact OH-O 2.76Å; E59-P94 HydrophobicContact CG-CB 3.71Å; E59-P94 HydrophobicContact CG-CG 3.49Å; E59-P94 VanDerWaalsContact CG-CG 3.49Å
95	K	87.8	Confident	85.2	Confident	176 Å²	176	61.8 Å²	61.8	77%	0.765	32%	0.321	S	S	*	.	S	Bend	trans	-103.2	-26.7	-170.7	-61	-177.6	-178.4	179.7	0	113.5	D93	D93-K95 PolarHBondContact O-N 2.86Å; D93-K95 WeakPolarHBondContact OD1-CA 3.45Å; D93-K95 WeakPolarHBondContact OD1-CB 3.48Å; D93-K95 PolarHBondContact OD1-N 3.49Å
96	I	87.2	Confident	85.1	Confident	100 Å²	100	58.6 Å²	58.6	51%	0.513	31%	0.307	S	S	.	.			trans	-125.1	144.8	-176.6	65.6	170.5	0	0	0	111.6	Q91 D93	Q91-I96 PolarHBondContact NE2-O 2.78Å; D93-I96 HydrophobicContact CB-CD1 4.37Å; D93-I96 HydrophobicContact CB-CG1 3.59Å; D93-I96 VanDerWaalsContact CG-CG1 3.5Å; D93-I96 PolarHBondContact O-N 2.8Å; D93-I96 PolarHBondContact OD1-N 3.45Å
97	L	85	Confident	84.6	Confident	130 Å²	130	60.3 Å²	60.3	68%	0.681	32%	0.316	S	S	*	.			trans	-84.4	132.3	165.1	-69.2	170.2	0	0	0	109	Q91 D101	Q91-L97 HydrophobicContact CG-CD2 4.34Å; L97-D101 VanDerWaalsContact CA-OD2 3.29Å; L97-D101 WeakPolarHBondContact CA-OD2 3.32Å
98	S	82.6	Confident	83.8	Confident	55 Å²	55	58.4 Å²	58.4	39%	0.385	31%	0.306	S	S	.	.			trans	-129	158	-178.1	177.3	0	0	0	0	110.7	Q100 D101	S98-Q100 PolarHBondContact O-N 3.03Å; S98-Q100 PolarHBondContact OG-N 2.98Å; S98-D101 PolarHBondContact N-OD2 2.87Å; S98-D101 WeakPolarHBondContact O-CB 3.49Å; S98-D101 PolarHBondContact O-N 2.82Å
99	G	82.3	Confident	82.6	Confident	89 Å²	89	62.6 Å²	62.6	92%	0.918	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-7	170.4	0	0	0	0	0	114
100	Q	81.5	Confident	81.2	Confident	112 Å²	112	63.1 Å²	63.1	52%	0.523	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-9.3	174.7	-63.4	-168.3	-0.1	0	0	114.6	R92 S98	R92-Q100 PolarHBondContact NE-O 3.06Å; R92-Q100 VanDerWaalsContact NE-O 3.08Å; R92-Q100 PolarHBondContact NH2-O 2.99Å; S98-Q100 PolarHBondContact O-N 3.03Å; S98-Q100 PolarHBondContact OG-N 2.98Å
101	D	87.2	Confident	79.2	Confident	31 Å²	31	66.7 Å²	66.7	17%	0.166	35%	0.354	C	S	.	.			trans	-74.2	150.3	179	-59.8	-24.8	0	0	0	110.3	V90 Q91 R92 L97 S98	V90-D101 WeakPolarHBondContact O-CA 3.38Å; Q91-D101 VanDerWaalsContact CA-OD1 3.29Å; Q91-D101 WeakPolarHBondContact CA-OD1 3.12Å; R92-D101 PolarHBondContact N-OD1 2.86Å; L97-D101 VanDerWaalsContact CA-OD2 3.29Å; L97-D101 WeakPolarHBondContact CA-OD2 3.32Å; S98-D101 PolarHBondContact N-OD2 2.87Å; S98-D101 WeakPolarHBondContact O-CB 3.49Å; S98-D101 PolarHBondContact O-N 2.82Å
102	Q	86	Confident	77.4	Confident	82 Å²	82	71.4 Å²	71.4	38%	0.383	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.3	-172.7	-60.4	-178.1	-13.4	0	0	111.5	I89 V90	I89-Q102 CarbonylContact C-O 3.58Å; I89-Q102 WeakPolarHBondContact CA-O 3.13Å; V90-Q102 HydrophobicContact CB-CB 4.31Å; V90-Q102 PolarHBondContact N-O 3.34Å; V90-Q102 PolarHBondContact O-N 3.46Å
103	L	82.6	Confident	75.2	Confident	48 Å²	48	73 Å²	73	25%	0.251	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	113.7	167.8	179.4	53.1	0	0	0	109.6	R7 D46 N87 L88 I89 Y105	R7-L103 PolarHBondContact NH1-O 3.29Å; R7-L103 PolarHBondContact NH2-O 2.97Å; D46-L103 HydrophobicContact CB-CD1 4.16Å; N87-L103 HydrophobicContact CB-CD1 3.92Å; L88-L103 CarbonylContact O-C 3.58Å; L88-L103 WeakPolarHBondContact O-CA 3.38Å; L88-L103 WeakPolarHBondContact O-CD1 3.29Å; I89-L103 HydrophobicContact CD1-CB 4.2Å; I89-L103 HydrophobicContact CD1-CD1 3.74Å; I89-L103 HydrophobicContact CD1-CG 4.45Å; L103-Y105 HydrophobicContact CB-CE2 4.47Å; L103-Y105 HydrophobicContact CD2-CE1 4.04Å; L103-Y105 HydrophobicContact CD2-CE2 3.92Å; L103-Y105 VanDerWaalsContact CD2-CZ 3.44Å; L103-Y105 WeakPolarHBondContact CD2-OH 3.45Å; L103-Y105 HydrophobicContact CG-CD2 4.32Å; L103-Y105 HydrophobicContact CG-CE1 4.24Å; L103-Y105 HydrophobicContact CG-CE2 3.76Å
104	L	80.7	Confident	73	Confident	17 Å²	17	72.3 Å²	72.3	9%	0.089	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.9	175.4	-71.9	158.9	0	0	0	109.5	D5 I33 N87 L88 V90	D5-L104 WeakPolarHBondContact OD2-CD2 3.23Å; I33-L104 HydrophobicContact CD1-CD1 3.89Å; N87-L104 CarbonylContact C-O 3.58Å; N87-L104 WeakPolarHBondContact CA-O 3.26Å; L88-L104 HydrophobicContact CB-CB 4.18Å; L88-L104 PolarHBondContact N-O 2.82Å; L88-L104 PolarHBondContact O-N 2.91Å; V90-L104 HydrophobicContact CG2-CD1 3.45Å; V90-L104 VanDerWaalsContact CG2-CD1 3.45Å; V90-L104 HydrophobicContact CG2-CG 4.4Å
105	Y	78.3	Confident	70.3	Confident	91 Å²	91	80.1 Å²	80.1	36%	0.357	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	105.6	179.9	-67.9	-86.4	0	0	0	110.1	D5 S6 R7 N87 L103	D5-Y105 CarbonylContact C-O 3.57Å; D5-Y105 VanDerWaalsContact CA-O 3.25Å; D5-Y105 WeakPolarHBondContact CA-O 3.46Å; S6-Y105 PolarHBondContact N-O 3.38Å; S6-Y105 WeakPolarHBondContact OG-CB 3.28Å; R7-Y105 HydrophobicContact CG-CD2 4.36Å; N87-Y105 VanDerWaalsContact OD1-CD1 3.25Å; N87-Y105 WeakPolarHBondContact OD1-CD1 3.2Å; L103-Y105 HydrophobicContact CB-CE2 4.47Å; L103-Y105 HydrophobicContact CD2-CE1 4.04Å; L103-Y105 HydrophobicContact CD2-CE2 3.92Å; L103-Y105 VanDerWaalsContact CD2-CZ 3.44Å; L103-Y105 WeakPolarHBondContact CD2-OH 3.45Å; L103-Y105 HydrophobicContact CG-CD2 4.32Å; L103-Y105 HydrophobicContact CG-CE1 4.24Å; L103-Y105 HydrophobicContact CG-CE2 3.76Å
106	I	77.5	Confident	68	Low	9 Å²	9	77.7 Å²	77.7	5%	0.046	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123	-178.1	-55.6	173.5	0	0	0	109.2	C3 F31 I69 Q85 H86 L88	C3-I106 HydrophobicContact CB-CG2 4.15Å; F31-I106 HydrophobicContact CD2-CD1 3.85Å; F31-I106 HydrophobicContact CE2-CD1 3.83Å; F31-I106 HydrophobicContact CE2-CG1 4.31Å; F31-I106 HydrophobicContact CG-CD1 4.38Å; F31-I106 HydrophobicContact CZ-CD1 4.31Å; I69-I106 HydrophobicContact CD1-CD1 3.69Å; Q85-I106 WeakPolarHBondContact CA-O 3.31Å; H86-I106 HydrophobicContact CB-CB 4.44Å; H86-I106 PolarHBondContact N-O 2.84Å; H86-I106 WeakPolarHBondContact O-CA 3.23Å; H86-I106 VanDerWaalsContact O-CB 3.3Å; H86-I106 WeakPolarHBondContact O-CB 3.14Å; H86-I106 PolarHBondContact O-N 2.89Å; L88-I106 HydrophobicContact CD1-CD1 3.58Å; L88-I106 HydrophobicContact CG-CD1 3.91Å
107	I	70.1	Confident	65.5	Low	43 Å²	43	80.7 Å²	80.7	22%	0.221	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	117.1	172.8	-57.2	-179.6	0	0	0	108.6	C3 S4 T83 Q85 L109	C3-I107 CarbonylContact C-O 3.52Å; C3-I107 VanDerWaalsContact CA-O 3.25Å; C3-I107 WeakPolarHBondContact CA-O 3.15Å; S4-I107 PolarHBondContact N-O 3.36Å; S4-I107 PolarHBondContact O-N 3.17Å; T83-I107 HydrophobicContact CG2-CG2 3.58Å; Q85-I107 HydrophobicContact CG-CG1 4.35Å; I107-L109 HydrophobicContact CG2-CD2 4.27Å
108	C	67.1	Low	63.5	Low	3 Å²	3	78.5 Å²	78.5	2%	0.02	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	102.3	175.4	-64.4	0	0	0	0	109.7	M1 I2 C3 T83 V84	M1-C108 HydrophobicContact CB-CB 4.29Å; M1-C108 HydrophobicContact CG-CB 4.33Å; M1-C108 HydrophobicContact SD-CB 3.95Å; I2-C108 CarbonylContact O-C 3.32Å; I2-C108 VanDerWaalsContact O-CA 3.24Å; I2-C108 WeakPolarHBondContact O-CA 3.5Å; C3-C108 HydrophobicContact CB-CB 4.11Å; C3-C108 WeakPolarHBondContact CB-SG 3.48Å; C3-C108 WeakPolarHBondContact SG-CB 3.06Å; C3-C108 CovalentContact SG-SG 2.04Å; C3-C108 PolarHBondContact SG-SG 2.72Å; T83-C108 CarbonylContact C-O 3.54Å; T83-C108 VanDerWaalsContact CA-O 3.32Å; T83-C108 WeakPolarHBondContact CA-O 3.02Å; T83-C108 WeakPolarHBondContact CG2-O 3.25Å; V84-C108 HydrophobicContact CB-CB 3.94Å; V84-C108 PolarHBondContact N-O 2.69Å; V84-C108 WeakPolarHBondContact O-CA 3.39Å; V84-C108 WeakPolarHBondContact O-CB 3.04Å; V84-C108 PolarHBondContact O-N 3.03Å
109	L	63	Low	61.5	Low	87 Å²	87	80 Å²	80	46%	0.455	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	138.3	174.9	-63.7	176.3	0	0	0	109.7	M1 I2 T83 I107 T111	M1-L109 CarbonylContact C-O 3.56Å; M1-L109 WeakPolarHBondContact CA-O 3.24Å; M1-L109 WeakPolarHBondContact CB-O 3.25Å; M1-L109 VanDerWaalsContact CG-O 3.28Å; M1-L109 WeakPolarHBondContact CG-O 3.07Å; I2-L109 PolarHBondContact N-O 2.89Å; I2-L109 PolarHBondContact O-N 3.4Å; T83-L109 HydrophobicContact CG2-CD2 4.13Å; I107-L109 HydrophobicContact CG2-CD2 4.27Å; L109-T111 PolarHBondContact O-N 2.05Å
110	P	60.7	Low	59.8	Low	33 Å²	33	84 Å²	84	21%	0.214	44%	0.438	C	S	.	.			trans	-60.3	139.1	167.9	27.6	-25.5	0	0	0	106.2	N81 T83 V112	N81-P110 VanDerWaalsContact O-CG 3.22Å; N81-P110 WeakPolarHBondContact O-CG 3.44Å; T83-P110 WeakPolarHBondContact OG1-CD 3.09Å; P110-V112 PolarHBondContact O-N 2.86Å
111	T	50	Low	58.7	Low	79 Å²	79	81.9 Å²	81.9	49%	0.485	43%	0.425	S	S	.	.			trans	-67	86.8	155.9	42	0	0	0	0	104.4	L109 N113	L109-T111 PolarHBondContact O-N 2.05Å; T111-N113 PolarHBondContact O-N 3.02Å
112	V	51.7	Low	58	Low	100 Å²	100	86.9 Å²	86.9	61%	0.606	45%	0.452	S	S	*	.			trans	-50	131.8	150.2	-82	0	0	0	0	103.5	P110 A114	P110-V112 PolarHBondContact O-N 2.86Å; V112-A114 HydrophobicContact CB-CB 4.28Å; V112-A114 VanDerWaalsContact CB-N 3.34Å; V112-A114 HydrophobicContact CG2-CB 3.7Å; V112-A114 PolarHBondContact O-N 3.17Å
113	N	40	Very low	57.6	Low	164 Å²	164	85.2 Å²	85.2	88%	0.877	45%	0.445	S	S	*	.			trans	-61.6	65	142.1	-72.4	-7.6	0	0	0	104.9	T111 Q115	T111-N113 PolarHBondContact O-N 3.02Å; N113-Q115 VanDerWaalsContact C-N 3.32Å; N113-Q115 PolarHBondContact O-N 3.36Å
114	A	41.3	Very low	57.8	Low	51 Å²	51	87.6 Å²	87.6	42%	0.421	46%	0.462	S	S	.	.			trans	-46.8	124.3	153.7	0	0	0	0	0	99.5	V112 L116	V112-A114 HydrophobicContact CB-CB 4.28Å; V112-A114 VanDerWaalsContact CB-N 3.34Å; V112-A114 HydrophobicContact CG2-CB 3.7Å; V112-A114 PolarHBondContact O-N 3.17Å; A114-L116 HydrophobicContact CB-CB 4.2Å; A114-L116 PolarHBondContact O-N 3.17Å
115	Q	33.6	Very low	58.1	Low	183 Å²	183	90.7 Å²	90.7	86%	0.855	47%	0.473	S	S	*	.			trans	-59	60.5	136.8	-55.5	-148	-15	0	0	107.1	N113 H117	N113-Q115 VanDerWaalsContact C-N 3.32Å; N113-Q115 PolarHBondContact O-N 3.36Å; Q115-H117 PolarHBondContact O-N 3.3Å
116	L	40	Very low	58.7	Low	124 Å²	124	92 Å²	92	65%	0.649	48%	0.48	S	S	*	.				-35.5	115.6	121.3	-157	82.1	0	0	0	100.6	A114 S118	A114-L116 HydrophobicContact CB-CB 4.2Å; A114-L116 PolarHBondContact O-N 3.17Å; L116-S118 VanDerWaalsContact CG-N 3.34Å; L116-S118 WeakPolarHBondContact O-CA 3.46Å; L116-S118 PolarHBondContact O-N 3.23Å
117	H	35.2	Very low	59.5	Low	163 Å²	163	93.4 Å²	93.4	76%	0.755	49%	0.494	S	S	*	.			trans	-51.1	70	134.7	-58.7	-84	0	0	0	107.3	Q115 M119	Q115-H117 PolarHBondContact O-N 3.3Å; H117-M119 HydrophobicContact CB-CG 4.09Å; H117-M119 PolarHBondContact O-N 2.96Å
118	S	42.2	Very low	60.7	Low	85 Å²	85	92.9 Å²	92.9	59%	0.594	49%	0.49	S	S	*	.				-42.7	77.3	101.2	-171.2	0	0	0	0	103.8	L116 E120	L116-S118 VanDerWaalsContact CG-N 3.34Å; L116-S118 WeakPolarHBondContact O-CA 3.46Å; L116-S118 PolarHBondContact O-N 3.23Å; S118-E120 PolarHBondContact O-N 2.95Å
119	M	41.4	Very low	62	Low	86 Å²	86	95 Å²	95	42%	0.424	50%	0.501	S	S	.	.			trans	-37.9	108.1	136.5	-66.5	178	169.3	0	0	99.7	H117 R121 H160	H117-M119 HydrophobicContact CB-CG 4.09Å; H117-M119 PolarHBondContact O-N 2.96Å; M119-R121 HydrophobicContact CB-CB 4.34Å; M119-R121 HydrophobicContact CB-CG 3.32Å; M119-R121 HydrophobicContact CG-CG 4.28Å; M119-R121 PolarHBondContact O-N 3.31Å; M119-R121 HydrophobicContact SD-CG 4.02Å; M119-R121 VanDerWaalsContact SD-CZ 3.6Å; M119-R121 PolarHBondContact SD-NE 2.9Å; M119-H160 PolarHBondContact SD-NE2 2.85Å
120	E	45.3	Very low	63.6	Low	172 Å²	172	92.6 Å²	92.6	80%	0.804	49%	0.486	S	S	*	.			trans	-49.9	79.6	140.4	-74	177.4	150.5	0	0	102.6	S118 N122	S118-E120 PolarHBondContact O-N 2.95Å; E120-N122 PolarHBondContact O-N 2.78Å
121	R	59.1	Low	65.3	Low	69 Å²	69	95.4 Å²	95.4	26%	0.26	49%	0.492	S	S	.	.			trans	-66.6	105	168.9	-64.2	-164.7	-179.7	-139.9	6.4	96.6	M119 I123 H160	M119-R121 HydrophobicContact CB-CB 4.34Å; M119-R121 HydrophobicContact CB-CG 3.32Å; M119-R121 HydrophobicContact CG-CG 4.28Å; M119-R121 PolarHBondContact O-N 3.31Å; M119-R121 HydrophobicContact SD-CG 4.02Å; M119-R121 VanDerWaalsContact SD-CZ 3.6Å; M119-R121 PolarHBondContact SD-NE 2.9Å; R121-I123 HydrophobicContact CB-CG1 4.19Å; R121-I123 HydrophobicContact CB-CG2 3.67Å; R121-I123 VanDerWaalsContact O-CG1 3.24Å; R121-I123 WeakPolarHBondContact O-CG1 3.48Å; R121-I123 PolarHBondContact O-N 2.96Å; R121-H160 VanDerWaalsContact CD-CD2 3.49Å; R121-H160 WeakPolarHBondContact CD-CD2 3.39Å; R121-H160 VanDerWaalsContact NH1-CB 3.28Å; R121-H160 PolarHBondContact NH1-CD2 2.73Å; R121-H160 PolarHBondContact NH1-ND1 3.31Å
122	N	71.6	Confident	67.4	Low	135 Å²	135	93 Å²	93	72%	0.722	48%	0.483	S	S	*	.			trans	-60.1	80	174	-81.6	-15.1	0	0	0	106	E120 G158	E120-N122 PolarHBondContact O-N 2.78Å; N122-G158 VanDerWaalsContact O-CA 3.28Å; N122-G158 WeakPolarHBondContact O-CA 3.48Å
123	I	78.1	Confident	69.5	Low	48 Å²	48	93.8 Å²	93.8	25%	0.246	48%	0.484	C	S	.	.			trans	-123.1	124.9	-174.4	63.3	109.9	0	0	0	108.1	R121 R157 F233	R121-I123 HydrophobicContact CB-CG1 4.19Å; R121-I123 HydrophobicContact CB-CG2 3.67Å; R121-I123 VanDerWaalsContact O-CG1 3.24Å; R121-I123 WeakPolarHBondContact O-CG1 3.48Å; R121-I123 PolarHBondContact O-N 2.96Å; I123-R157 CarbonylContact C-O 3.54Å; I123-R157 WeakPolarHBondContact CA-O 3.32Å; I123-F233 HydrophobicContact CD1-CE1 4.15Å; I123-F233 HydrophobicContact CD1-CZ 3.59Å; I123-F233 HydrophobicContact CG1-CE1 4.28Å; I123-F233 HydrophobicContact CG1-CZ 4.08Å; I123-F233 HydrophobicContact CG2-CE1 4.43Å
124	T	86.1	Confident	72.1	Confident	97 Å²	97	86.3 Å²	86.3	60%	0.595	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	116.4	170.9	-51.3	0	0	0	0	107.4	V156 R157	T124-V156 WeakPolarHBondContact O-CA 3.22Å; T124-R157 PolarHBondContact N-O 3.13Å; T124-R157 PolarHBondContact O-N 3.29Å
125	Y	88.9	Confident	74.6	Confident	83 Å²	83	85.3 Å²	85.3	33%	0.325	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.8	173.7	177.3	-97.2	0	0	0	109.6	A127 Y152 A154 R155 V156 L231	Y125-A127 HydrophobicContact CE1-CB 3.77Å; Y125-Y152 PolarHBondContact OH-OH 3.13Å; Y125-Y152 VanDerWaalsContact OH-OH 3.09Å; Y125-A154 HydrophobicContact CE2-CB 3.68Å; Y125-R155 WeakPolarHBondContact CA-O 3.21Å; Y125-V156 HydrophobicContact CD2-CG2 3.88Å; Y125-V156 HydrophobicContact CE2-CG2 4.34Å; Y125-L231 HydrophobicContact CD2-CD1 4.45Å; Y125-L231 HydrophobicContact CD2-CD2 3.67Å; Y125-L231 HydrophobicContact CE2-CD1 4.12Å; Y125-L231 HydrophobicContact CE2-CD2 4.05Å; Y125-L231 HydrophobicContact CE2-CG 4.5Å; Y125-L231 HydrophobicContact CG-CD2 4.4Å
126	K	90.8	Very high	77.5	Confident	117 Å²	117	84 Å²	84	51%	0.509	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	119.4	173.9	-175.5	-176.2	175.4	-160.7	0	109.7	E128 A154 R155	K126-E128 WeakPolarHBondContact CE-OE2 3.49Å; K126-E128 IonicContact NZ-OE2 3.68Å; K126-E128 PolarHBondContact NZ-OE2 2.82Å; K126-A154 CarbonylContact O-C 3.55Å; K126-A154 WeakPolarHBondContact O-CA 3.42Å; K126-R155 PolarHBondContact N-O 2.91Å; K126-R155 PolarHBondContact O-N 2.91Å
127	A	94.3	Very high	80	Confident	40 Å²	40	79.2 Å²	79.2	33%	0.331	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.6	174.5	0	0	0	0	0	111.3	Y125 Y152 V153	Y125-A127 HydrophobicContact CE1-CB 3.77Å; A127-Y152 HydrophobicContact CB-CE1 4.17Å; A127-Y152 HydrophobicContact CB-CE2 4.33Å; A127-Y152 VanDerWaalsContact CB-OH 3.29Å; A127-Y152 WeakPolarHBondContact CB-OH 3.26Å; A127-V153 CarbonylContact C-O 3.41Å; A127-V153 VanDerWaalsContact CA-O 3.32Å; A127-V153 WeakPolarHBondContact CA-O 3.46Å
128	E	93.3	Very high	82.8	Confident	31 Å²	31	78.3 Å²	78.3	15%	0.145	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	157.5	177.9	60	-169.1	-166.2	0	0	111.3	K126 R130 V153	K126-E128 WeakPolarHBondContact CE-OE2 3.49Å; K126-E128 IonicContact NZ-OE2 3.68Å; K126-E128 PolarHBondContact NZ-OE2 2.82Å; E128-R130 HydrophobicContact CG-CG 4.39Å; E128-R130 IonicContact OE1-CZ 2.67Å; E128-R130 IonicContact OE1-NE 3.54Å; E128-R130 PolarHBondContact OE1-NE 2.79Å; E128-R130 IonicContact OE1-NH2 3.98Å; E128-R130 PolarHBondContact OE1-NH2 3.38Å; E128-V153 PolarHBondContact N-O 2.84Å; E128-V153 PolarHBondContact O-N 2.67Å
129	I	95.2	Very high	85.3	Confident	48 Å²	48	76.4 Å²	76.4	25%	0.246	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.6	171.8	-52.5	-59.9	0	0	0	108.9	V140 L150 S151 Y152 I214 I227	I129-V140 HydrophobicContact CB-CG2 4.27Å; I129-V140 HydrophobicContact CG2-CG2 3.81Å; I129-V140 PolarHBondContact O-N 3.13Å; I129-L150 HydrophobicContact CG2-CB 4.15Å; I129-L150 HydrophobicContact CG2-CD1 4.09Å; I129-L150 HydrophobicContact CG2-CD2 4.46Å; I129-L150 HydrophobicContact CG2-CG 4.48Å; I129-S151 WeakPolarHBondContact CA-O 3.49Å; I129-Y152 HydrophobicContact CD1-CD2 3.63Å; I129-Y152 HydrophobicContact CD1-CG 4.31Å; I129-I214 HydrophobicContact CD1-CD1 4.26Å; I129-I227 HydrophobicContact CD1-CD1 4.15Å
130	R	96.1	Very high	87.7	Confident	37 Å²	37	74.2 Å²	74.2	14%	0.14	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.2	178.2	-71.6	-178.4	167.5	-127.2	4.5	111.1	E128 Y135 G137 Q138 L150 S151 V153	E128-R130 HydrophobicContact CG-CG 4.39Å; E128-R130 IonicContact OE1-CZ 2.67Å; E128-R130 IonicContact OE1-NE 3.54Å; E128-R130 PolarHBondContact OE1-NE 2.79Å; E128-R130 IonicContact OE1-NH2 3.98Å; E128-R130 PolarHBondContact OE1-NH2 3.38Å; R130-Y135 WeakPolarHBondContact CD-O 3.45Å; R130-Y135 PolarHBondContact NH1-O 2.97Å; R130-G137 WeakPolarHBondContact CD-O 3.48Å; R130-G137 WeakPolarHBondContact CG-O 3.4Å; R130-G137 PolarHBondContact NH1-O 3.49Å; R130-Q138 CarbonylContact C-O 3.57Å; R130-Q138 WeakPolarHBondContact CA-O 3.33Å; R130-L150 CarbonylContact O-C 3.52Å; R130-L150 VanDerWaalsContact O-CA 3.31Å; R130-L150 WeakPolarHBondContact O-CA 3.35Å; R130-S151 PolarHBondContact N-O 3.42Å; R130-S151 PolarHBondContact O-N 3.4Å; R130-V153 HydrophobicContact CB-CG2 4.24Å; R130-V153 HydrophobicContact CG-CG2 4.22Å
131	R	96.1	Very high	89.7	Confident	91 Å²	91	73.5 Å²	73.5	34%	0.343	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	143.5	175.2	-65.1	-172.1	-175.6	-117.5	2.6	111.2	G137 Q138 V140 Q141 E143 E148 L150	R131-G137 VanDerWaalsContact O-CA 3.31Å; R131-G137 WeakPolarHBondContact O-CA 3.05Å; R131-Q138 PolarHBondContact N-O 3.2Å; R131-V140 HydrophobicContact CG-CG2 3.95Å; R131-Q141 PolarHBondContact NH2-O 3.19Å; R131-Q141 VanDerWaalsContact NH2-O 3.13Å; R131-E143 PolarHBondContact NH2-O 2.89Å; R131-E148 IonicContact CZ-OE1 3.6Å; R131-E148 IonicContact NE-OE1 2.73Å; R131-E148 IonicContact NH1-OE1 2.63Å; R131-E148 PolarHBondContact NH1-OE1 2.82Å; R131-E148 IonicContact NH1-OE2 3.06Å; R131-E148 PolarHBondContact NH1-OE2 3.1Å; R131-L150 HydrophobicContact CB-CD2 4.4Å; R131-L150 HydrophobicContact CG-CD2 4.06Å
132	G	95.9	Very high	91.1	Very high	29 Å²	29	73.5 Å²	73.5	30%	0.299	40%	0.395	S	S	.	.	S	Bend	trans	86.5	-174.6	179.1	0	0	0	0	0	114.5	A149 L150 S151	G132-A149 WeakPolarHBondContact CA-O 3.2Å; G132-A149 PolarHBondContact N-O 2.86Å; G132-L150 CarbonylContact O-C 3.59Å; G132-L150 WeakPolarHBondContact O-CA 3.28Å; G132-S151 PolarHBondContact O-N 3.25Å; G132-S151 PolarHBondContact O-OG 3.07Å
133	N	95.1	Very high	91.8	Very high	117 Å²	117	75.9 Å²	75.9	63%	0.626	40%	0.401	S	S	*	.	S	Bend	trans	-96.1	109.2	-179.8	-65.1	-45.8	0	0	0	110	K213	N133-K213 HydrophobicContact CB-CD 4.47Å; N133-K213 HydrophobicContact CB-CG 4.44Å
134	G	94.4	Very high	92.3	Very high	7 Å²	7	76.9 Å²	76.9	7%	0.072	41%	0.407	C	S	.	.	S	Bend	trans	117.1	-175.7	179.7	0	0	0	0	0	113.8	S151	G134-S151 PolarHBondContact N-OG 3.2Å; G134-S151 VanDerWaalsContact O-CB 3.23Å; G134-S151 WeakPolarHBondContact O-CB 3.41Å; G134-S151 PolarHBondContact O-OG 3.4Å
135	Y	94.8	Very high	92.6	Very high	29 Å²	29	78.3 Å²	78.3	11%	0.114	41%	0.411	C	S	.	.	S	Bend	trans	-98	-2	-169.9	63.6	-83.4	0	0	0	115.5	R130 V201 L203 V209 Y211	R130-Y135 WeakPolarHBondContact CD-O 3.45Å; R130-Y135 PolarHBondContact NH1-O 2.97Å; Y135-V201 HydrophobicContact CD1-CG2 4.48Å; Y135-V201 HydrophobicContact CE1-CB 4.27Å; Y135-V201 HydrophobicContact CE1-CG1 4.41Å; Y135-V201 HydrophobicContact CE1-CG2 3.79Å; Y135-L203 HydrophobicContact CE2-CD2 4.06Å; Y135-V209 HydrophobicContact CD1-CG1 4.49Å; Y135-V209 HydrophobicContact CD2-CB 4.44Å; Y135-V209 HydrophobicContact CD2-CG1 4.07Å; Y135-V209 HydrophobicContact CD2-CG2 4.36Å; Y135-V209 HydrophobicContact CG-CG1 3.81Å; Y135-Y211 AromaticContact CD1-CD1 3.42Å; Y135-Y211 HydrophobicContact CD1-CD1 3.42Å; Y135-Y211 VanDerWaalsContact CD1-CD1 3.42Å; Y135-Y211 AromaticContact CD1-CE1 3.43Å; Y135-Y211 HydrophobicContact CD1-CE1 3.43Å; Y135-Y211 VanDerWaalsContact CD1-CE1 3.43Å; Y135-Y211 HydrophobicContact CD1-CG 4.17Å; Y135-Y211 HydrophobicContact CE1-CD1 4.26Å; Y135-Y211 AromaticContact CE1-CE1 3.89Å; Y135-Y211 HydrophobicContact CE1-CE1 3.89Å; Y135-Y211 HydrophobicContact CG-CD1 4.11Å
136	F	93.5	Very high	92.7	Very high	157 Å²	157	80 Å²	80	69%	0.689	43%	0.43	S	S	*	.	S	Bend	trans	-88.4	-14.2	-179.9	-60.7	-74.9	0	0	0	113.9
137	G	92.7	Very high	92.8	Very high	22 Å²	22	76 Å²	76	23%	0.227	42%	0.421	C	S	.	.	S	Bend	trans	-60.2	161.6	-177.8	0	0	0	0	0	113.7	R130 R131	R130-G137 WeakPolarHBondContact CD-O 3.48Å; R130-G137 WeakPolarHBondContact CG-O 3.4Å; R130-G137 PolarHBondContact NH1-O 3.49Å; R131-G137 VanDerWaalsContact O-CA 3.31Å; R131-G137 WeakPolarHBondContact O-CA 3.05Å
138	Q	94.8	Very high	92.8	Very high	144 Å²	144	76 Å²	76	67%	0.673	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-70.2	142.8	175.8	-65.5	-60.3	-30.1	0	0	110.7	R130 R131	R130-Q138 CarbonylContact C-O 3.57Å; R130-Q138 WeakPolarHBondContact CA-O 3.33Å; R131-Q138 PolarHBondContact N-O 3.2Å
139	P	94.8	Very high	93	Very high	45 Å²	45	76.5 Å²	76.5	29%	0.292	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-54	140.5	169.7	-23.8	34.2	0	0	0	110.6	Q141	P139-Q141 PolarHBondContact O-N 3Å
140	V	91.1	Very high	93.1	Very high	41 Å²	41	74.6 Å²	74.6	25%	0.248	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-62.6	122.3	177.5	173	0	0	0	0	109.4	I129 R131 L144 L150	I129-V140 HydrophobicContact CB-CG2 4.27Å; I129-V140 HydrophobicContact CG2-CG2 3.81Å; I129-V140 PolarHBondContact O-N 3.13Å; R131-V140 HydrophobicContact CG-CG2 3.95Å; V140-L144 HydrophobicContact CG1-CD1 3.77Å; V140-L144 HydrophobicContact CG1-CD2 3.68Å; V140-L144 HydrophobicContact CG1-CG 3.71Å; V140-L144 HydrophobicContact CG2-CD1 4.32Å; V140-L144 HydrophobicContact CG2-CD2 4.05Å; V140-L150 HydrophobicContact CG2-CD2 3.82Å
141	Q	87.6	Confident	93.1	Very high	156 Å²	156	72.8 Å²	72.8	73%	0.729	41%	0.407	S	S	*	.			trans	-119.3	134.7	167.1	-62	179.9	8.7	0	0	107.7	R131 P139	R131-Q141 PolarHBondContact NH2-O 3.19Å; R131-Q141 VanDerWaalsContact NH2-O 3.13Å; P139-Q141 PolarHBondContact O-N 3Å
142	G	87.5	Confident	93.2	Very high	70 Å²	70	69.2 Å²	69.2	72%	0.722	39%	0.394	S	S	*	.	S	Bend	trans	77	-159.6	178.7	0	0	0	0	0	114.8
143	E	86.4	Confident	93.2	Very high	184 Å²	184	67.9 Å²	67.9	86%	0.86	38%	0.38	S	S	*	.			trans	-74.9	155.8	-177.3	-61.5	-177.1	165.7	0	0	112.3	R131	R131-E143 PolarHBondContact NH2-O 2.89Å
144	L	89.8	Confident	93.2	Very high	70 Å²	70	62.3 Å²	62.3	37%	0.366	35%	0.35	S	S	.	.			trans	-124.8	143.3	-178.6	-72.3	172	0	0	0	109.9	V140 E148 L150	V140-L144 HydrophobicContact CG1-CD1 3.77Å; V140-L144 HydrophobicContact CG1-CD2 3.68Å; V140-L144 HydrophobicContact CG1-CG 3.71Å; V140-L144 HydrophobicContact CG2-CD1 4.32Å; V140-L144 HydrophobicContact CG2-CD2 4.05Å; L144-E148 WeakPolarHBondContact CD2-OE2 3.45Å; L144-L150 HydrophobicContact CD1-CD1 3.64Å; L144-L150 HydrophobicContact CD2-CD1 4.24Å; L144-L150 HydrophobicContact CD2-CD2 3.9Å
145	N	92	Very high	93.2	Very high	126 Å²	126	64.7 Å²	64.7	67%	0.674	36%	0.357	S	S	*	.			trans	-90.5	139.6	173.8	-67.6	-51.3	0	0	0	110.5	G147 E148 A216	N145-G147 PolarHBondContact O-N 3.42Å; N145-E148 PolarHBondContact N-OE2 3.16Å; N145-E148 WeakPolarHBondContact O-CB 3.12Å; N145-E148 PolarHBondContact O-N 2.9Å; N145-E148 VanDerWaalsContact O-N 3.1Å; N145-A216 VanDerWaalsContact O-CB 3.26Å; N145-A216 WeakPolarHBondContact O-CB 3.02Å
146	V	91	Very high	93.1	Very high	119 Å²	119	63.3 Å²	63.3	72%	0.721	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	133	170.2	176.3	0	0	0	0	109.1
147	G	92.6	Very high	93	Very high	32 Å²	32	63.5 Å²	63.5	33%	0.33	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	-9.6	-177.9	0	0	0	0	0	115.3	N145 K215 A216	N145-G147 PolarHBondContact O-N 3.42Å; G147-K215 VanDerWaalsContact CA-CE 3.5Å; G147-K215 WeakPolarHBondContact O-CE 3.49Å; G147-A216 PolarHBondContact N-O 2.9Å
148	E	94.7	Very high	92.8	Very high	42 Å²	42	62.9 Å²	62.9	20%	0.196	34%	0.342	C	S	.	.			trans	-60.5	140.1	175.9	-171.2	174.2	166.4	0	0	111.4	R131 L144 N145 L150 A216	R131-E148 IonicContact CZ-OE1 3.6Å; R131-E148 IonicContact NE-OE1 2.73Å; R131-E148 IonicContact NH1-OE1 2.63Å; R131-E148 PolarHBondContact NH1-OE1 2.82Å; R131-E148 IonicContact NH1-OE2 3.06Å; R131-E148 PolarHBondContact NH1-OE2 3.1Å; L144-E148 WeakPolarHBondContact CD2-OE2 3.45Å; N145-E148 PolarHBondContact N-OE2 3.16Å; N145-E148 WeakPolarHBondContact O-CB 3.12Å; N145-E148 PolarHBondContact O-N 2.9Å; N145-E148 VanDerWaalsContact O-N 3.1Å; E148-L150 HydrophobicContact CG-CD2 4.45Å; E148-L150 PolarHBondContact O-N 3.49Å; E148-A216 HydrophobicContact CB-CB 4.02Å; E148-A216 WeakPolarHBondContact O-CB 3.26Å; E148-A216 PolarHBondContact O-N 3.05Å
149	A	96.6	Very high	92.3	Very high	41 Å²	41	59.5 Å²	59.5	34%	0.339	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	122.8	175.8	0	0	0	0	0	110	G132	G132-A149 WeakPolarHBondContact CA-O 3.2Å; G132-A149 PolarHBondContact N-O 2.86Å
150	L	96.9	Very high	91.5	Very high	7 Å²	7	59.7 Å²	59.7	4%	0.037	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	171.4	-178.8	-63.7	178.3	0	0	0	109.8	I129 R130 R131 G132 V140 L144 E148 I214 A216	I129-L150 HydrophobicContact CG2-CB 4.15Å; I129-L150 HydrophobicContact CG2-CD1 4.09Å; I129-L150 HydrophobicContact CG2-CD2 4.46Å; I129-L150 HydrophobicContact CG2-CG 4.48Å; R130-L150 CarbonylContact O-C 3.52Å; R130-L150 VanDerWaalsContact O-CA 3.31Å; R130-L150 WeakPolarHBondContact O-CA 3.35Å; R131-L150 HydrophobicContact CB-CD2 4.4Å; R131-L150 HydrophobicContact CG-CD2 4.06Å; G132-L150 CarbonylContact O-C 3.59Å; G132-L150 WeakPolarHBondContact O-CA 3.28Å; V140-L150 HydrophobicContact CG2-CD2 3.82Å; L144-L150 HydrophobicContact CD1-CD1 3.64Å; L144-L150 HydrophobicContact CD2-CD1 4.24Å; L144-L150 HydrophobicContact CD2-CD2 3.9Å; E148-L150 HydrophobicContact CG-CD2 4.45Å; E148-L150 PolarHBondContact O-N 3.49Å; L150-I214 HydrophobicContact CB-CB 4.05Å; L150-I214 HydrophobicContact CB-CG2 4.43Å; L150-I214 PolarHBondContact N-O 2.91Å; L150-I214 PolarHBondContact O-N 2.83Å; L150-I214 VanDerWaalsContact O-O 3.08Å; L150-A216 HydrophobicContact CD1-CB 3.74Å; L150-A216 HydrophobicContact CG-CB 4.35Å
151	S	97.2	Very high	91.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.6	172.8	-63.3	0	0	0	0	111.2	I129 R130 G132 G134 N212	I129-S151 WeakPolarHBondContact CA-O 3.49Å; R130-S151 PolarHBondContact N-O 3.42Å; R130-S151 PolarHBondContact O-N 3.4Å; G132-S151 PolarHBondContact O-N 3.25Å; G132-S151 PolarHBondContact O-OG 3.07Å; G134-S151 PolarHBondContact N-OG 3.2Å; G134-S151 VanDerWaalsContact O-CB 3.23Å; G134-S151 WeakPolarHBondContact O-CB 3.41Å; G134-S151 PolarHBondContact O-OG 3.4Å; S151-N212 WeakPolarHBondContact CA-O 3.32Å; S151-N212 WeakPolarHBondContact CB-O 2.98Å; S151-N212 PolarHBondContact OG-O 2.87Å
152	Y	97.4	Very high	91.2	Very high	16 Å²	16	52.1 Å²	52.1	6%	0.063	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	130.9	164.4	-174.7	-86.8	0	0	0	107.9	Y125 A127 I129 A154 I166 W195 F198 Y211 N212 I227	Y125-Y152 PolarHBondContact OH-OH 3.13Å; Y125-Y152 VanDerWaalsContact OH-OH 3.09Å; A127-Y152 HydrophobicContact CB-CE1 4.17Å; A127-Y152 HydrophobicContact CB-CE2 4.33Å; A127-Y152 VanDerWaalsContact CB-OH 3.29Å; A127-Y152 WeakPolarHBondContact CB-OH 3.26Å; I129-Y152 HydrophobicContact CD1-CD2 3.63Å; I129-Y152 HydrophobicContact CD1-CG 4.31Å; Y152-A154 HydrophobicContact CE1-CB 4.01Å; Y152-I166 HydrophobicContact CD1-CD1 4.44Å; Y152-I166 HydrophobicContact CE1-CD1 4.07Å; Y152-W195 HydrophobicContact CD2-CH2 4.38Å; Y152-W195 HydrophobicContact CG-CH2 4.28Å; Y152-F198 AromaticContact CD1-CE1 3.82Å; Y152-F198 HydrophobicContact CD1-CE1 3.82Å; Y152-F198 HydrophobicContact CD1-CZ 4.06Å; Y152-F198 HydrophobicContact CE1-CE1 4.48Å; Y152-Y211 WeakPolarHBondContact O-CA 3.48Å; Y152-Y211 WeakPolarHBondContact O-CB 3.48Å; Y152-N212 WeakPolarHBondContact CB-OD1 3.36Å; Y152-N212 PolarHBondContact N-O 3.5Å; Y152-N212 PolarHBondContact N-OD1 2.91Å; Y152-N212 PolarHBondContact O-N 2.03Å; Y152-N212 VanDerWaalsContact O-N 3.12Å; Y152-I227 HydrophobicContact CD2-CG2 4.06Å; Y152-I227 HydrophobicContact CE2-CG2 4.03Å
153	V	96.4	Very high	91.2	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	114.1	-175.6	-176.7	0	0	0	0	108.8	A127 E128 R130 R155 V209	A127-V153 CarbonylContact C-O 3.41Å; A127-V153 VanDerWaalsContact CA-O 3.32Å; A127-V153 WeakPolarHBondContact CA-O 3.46Å; E128-V153 PolarHBondContact N-O 2.84Å; E128-V153 PolarHBondContact O-N 2.67Å; R130-V153 HydrophobicContact CB-CG2 4.24Å; R130-V153 HydrophobicContact CG-CG2 4.22Å; V153-R155 HydrophobicContact CG1-CG 4.41Å; V153-V209 HydrophobicContact CG1-CG1 3.66Å
154	A	95.7	Very high	91.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.1	171.8	0	0	0	0	0	109.9	Y125 K126 Y152 I166 V209 L210	Y125-A154 HydrophobicContact CE2-CB 3.68Å; K126-A154 CarbonylContact O-C 3.55Å; K126-A154 WeakPolarHBondContact O-CA 3.42Å; Y152-A154 HydrophobicContact CE1-CB 4.01Å; A154-I166 HydrophobicContact CB-CD1 3.85Å; A154-V209 WeakPolarHBondContact O-CA 3.15Å; A154-L210 HydrophobicContact CB-CB 4.35Å; A154-L210 PolarHBondContact N-O 2.91Å; A154-L210 PolarHBondContact O-N 2.92Å
155	R	93.9	Very high	91.2	Very high	58 Å²	58	40.6 Å²	40.6	22%	0.219	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	127.6	171.9	-59.4	-173.4	171.5	-99.2	-4.6	108.7	Y125 K126 V153 E207 V209	Y125-R155 WeakPolarHBondContact CA-O 3.21Å; K126-R155 PolarHBondContact N-O 2.91Å; K126-R155 PolarHBondContact O-N 2.91Å; V153-R155 HydrophobicContact CG1-CG 4.41Å; R155-E207 IonicContact NH1-OE1 3.4Å; R155-V209 HydrophobicContact CG-CG2 4.19Å
156	V	92.7	Very high	91.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.5	177.4	-167.8	0	0	0	0	107.9	T124 Y125 A161 V164 E207 V208 L231	T124-V156 WeakPolarHBondContact O-CA 3.22Å; Y125-V156 HydrophobicContact CD2-CG2 3.88Å; Y125-V156 HydrophobicContact CE2-CG2 4.34Å; V156-A161 HydrophobicContact CB-CB 4.46Å; V156-A161 HydrophobicContact CG1-CB 4.23Å; V156-A161 WeakPolarHBondContact O-CB 3.14Å; V156-V164 HydrophobicContact CB-CG2 4.13Å; V156-V164 HydrophobicContact CG1-CG1 4.33Å; V156-V164 HydrophobicContact CG1-CG2 4.25Å; V156-V164 HydrophobicContact CG2-CG2 3.94Å; V156-E207 WeakPolarHBondContact O-CA 3.19Å; V156-V208 HydrophobicContact CB-CG2 3.85Å; V156-V208 HydrophobicContact CG2-CG2 4.3Å; V156-V208 PolarHBondContact N-O 2.8Å; V156-V208 PolarHBondContact O-N 3.13Å; V156-L231 HydrophobicContact CG2-CD1 4.41Å
157	R	90.7	Very high	91.1	Very high	160 Å²	160	29.2 Å²	29.2	60%	0.604	16%	0.156	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.5	175.5	-175.3	175.2	178.6	149	-2.1	110.2	I123 T124 D206	I123-R157 CarbonylContact C-O 3.54Å; I123-R157 WeakPolarHBondContact CA-O 3.32Å; T124-R157 PolarHBondContact N-O 3.13Å; T124-R157 PolarHBondContact O-N 3.29Å; R157-D206 CarbonylContact C-O 3.36Å; R157-D206 WeakPolarHBondContact CA-O 3.4Å
158	G	89.5	Confident	90.8	Very high	10 Å²	10	31.4 Å²	31.4	10%	0.103	15%	0.154	C	C	.	.	S	Bend	trans	140.8	171	175.6	0	0	0	0	0	112.8	N122 H160 A161 D206	N122-G158 VanDerWaalsContact O-CA 3.28Å; N122-G158 WeakPolarHBondContact O-CA 3.48Å; G158-H160 PolarHBondContact O-N 3.36Å; G158-A161 VanDerWaalsContact O-CB 3.23Å; G158-A161 WeakPolarHBondContact O-CB 3.49Å; G158-A161 PolarHBondContact O-N 2.88Å; G158-D206 PolarHBondContact N-O 3.04Å
159	S	83.4	Confident	90.7	Very high	72 Å²	72	29.4 Å²	29.4	50%	0.503	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-11.8	-171.4	59.6	0	0	0	0	116.3
160	H	79.6	Confident	90.5	Very high	49 Å²	49	30.2 Å²	30.2	23%	0.227	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.9	15.2	-179.5	-64.1	-63.4	0	0	0	113.3	M119 R121 G158 S162 N163	M119-H160 PolarHBondContact SD-NE2 2.85Å; R121-H160 VanDerWaalsContact CD-CD2 3.49Å; R121-H160 WeakPolarHBondContact CD-CD2 3.39Å; R121-H160 VanDerWaalsContact NH1-CB 3.28Å; R121-H160 PolarHBondContact NH1-CD2 2.73Å; R121-H160 PolarHBondContact NH1-ND1 3.31Å; G158-H160 PolarHBondContact O-N 3.36Å; H160-S162 PolarHBondContact O-N 2.89Å; H160-N163 PolarHBondContact O-N 2.87Å; H160-N163 VanDerWaalsContact O-N 3.15Å
161	A	84.9	Confident	90.2	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-59.3	-33.3	179.1	0	0	0	0	0	112.4	V156 G158 N163 V164 K200 D206 V208	V156-A161 HydrophobicContact CB-CB 4.46Å; V156-A161 HydrophobicContact CG1-CB 4.23Å; V156-A161 WeakPolarHBondContact O-CB 3.14Å; G158-A161 VanDerWaalsContact O-CB 3.23Å; G158-A161 WeakPolarHBondContact O-CB 3.49Å; G158-A161 PolarHBondContact O-N 2.88Å; A161-N163 PolarHBondContact O-N 2.04Å; A161-N163 VanDerWaalsContact O-N 3.15Å; A161-V164 WeakPolarHBondContact O-CG2 3.34Å; A161-V164 PolarHBondContact O-N 2.92Å; A161-K200 PolarHBondContact O-NZ 3.04Å; A161-D206 WeakPolarHBondContact CB-O 3.5Å; A161-V208 HydrophobicContact CB-CG1 4.31Å; A161-V208 HydrophobicContact CB-CG2 4.16Å; A161-V208 WeakPolarHBondContact O-CG1 3.29Å; A161-V208 VanDerWaalsContact O-CG2 3.24Å; A161-V208 WeakPolarHBondContact O-CG2 3.34Å
162	S	85.8	Confident	89.6	Confident	37 Å²	37	31 Å²	31	26%	0.259	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-61.9	-22.1	177.5	57.5	0	0	0	0	114.2	H160 K200	H160-S162 PolarHBondContact O-N 2.89Å; S162-K200 VanDerWaalsContact C-NZ 3.27Å; S162-K200 PolarHBondContact O-NZ 2.76Å
163	N	87.2	Confident	88.8	Confident	26 Å²	26	31.2 Å²	31.2	14%	0.139	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-112.4	36.8	-177.3	-65.3	-24.2	0	0	0	112.8	H160 A161 F233 C234 G236	H160-N163 PolarHBondContact O-N 2.87Å; H160-N163 VanDerWaalsContact O-N 3.15Å; A161-N163 PolarHBondContact O-N 2.04Å; A161-N163 VanDerWaalsContact O-N 3.15Å; N163-F233 WeakPolarHBondContact O-CA 3.25Å; N163-C234 HydrophobicContact CB-CB 4.47Å; N163-C234 WeakPolarHBondContact CB-O 3.13Å; N163-C234 PolarHBondContact O-N 2.92Å; N163-G236 WeakPolarHBondContact CB-O 3.26Å; N163-G236 VanDerWaalsContact CG-C 3.48Å; N163-G236 VanDerWaalsContact OD1-C 3.3Å; N163-G236 PolarHBondContact OD1-O 3.17Å
164	V	88.4	Confident	88.1	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	149.6	172.4	-58.2	0	0	0	0	113.6	V156 A161 K200 V208 L210 L231 H232 F233 C238	V156-V164 HydrophobicContact CB-CG2 4.13Å; V156-V164 HydrophobicContact CG1-CG1 4.33Å; V156-V164 HydrophobicContact CG1-CG2 4.25Å; V156-V164 HydrophobicContact CG2-CG2 3.94Å; A161-V164 WeakPolarHBondContact O-CG2 3.34Å; A161-V164 PolarHBondContact O-N 2.92Å; V164-K200 PolarHBondContact O-NZ 2.98Å; V164-V208 HydrophobicContact CG2-CG2 3.66Å; V164-L210 HydrophobicContact CG2-CD1 3.83Å; V164-L231 HydrophobicContact CB-CD1 4.1Å; V164-L231 HydrophobicContact CG2-CD1 4.46Å; V164-H232 VanDerWaalsContact CA-O 3.29Å; V164-H232 WeakPolarHBondContact CA-O 3.36Å; V164-F233 HydrophobicContact CG1-CD1 3.55Å; V164-F233 HydrophobicContact CG1-CE1 3.56Å; V164-F233 HydrophobicContact CG1-CG 4.31Å; V164-F233 HydrophobicContact CG1-CZ 4.32Å; V164-C238 VanDerWaalsContact C-SG 3.6Å
165	R	88.5	Confident	87.3	Confident	55 Å²	55	46.2 Å²	46.2	21%	0.208	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156.7	167.7	69.7	174.2	-177.1	87.6	-0.6	110.9	D183 N184 H232 C238	R165-D183 PolarHBondContact NH1-O 2.63Å; R165-D183 PolarHBondContact NH2-O 2.86Å; R165-N184 PolarHBondContact NH1-O 3.27Å; R165-H232 HydrophobicContact CG-CB 3.91Å; R165-H232 PolarHBondContact N-O 2.89Å; R165-H232 PolarHBondContact O-N 3.25Å; R165-C238 HydrophobicContact CB-CB 3.98Å; R165-C238 HydrophobicContact CG-CB 4.19Å
166	I	90.9	Very high	86.7	Confident	6 Å²	6	45 Å²	45	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.4	167.3	-70.9	163.8	0	0	0	108.6	Y152 A154 C169 F198 L210 C229 L231	Y152-I166 HydrophobicContact CD1-CD1 4.44Å; Y152-I166 HydrophobicContact CE1-CD1 4.07Å; A154-I166 HydrophobicContact CB-CD1 3.85Å; I166-C169 WeakPolarHBondContact CG2-SG 3.3Å; I166-F198 HydrophobicContact CB-CD1 4.41Å; I166-F198 HydrophobicContact CB-CD2 3.96Å; I166-F198 HydrophobicContact CB-CE1 4.4Å; I166-F198 HydrophobicContact CB-CE2 3.92Å; I166-F198 HydrophobicContact CB-CG 4.2Å; I166-F198 HydrophobicContact CB-CZ 4.15Å; I166-F198 HydrophobicContact CD1-CD1 3.71Å; I166-F198 HydrophobicContact CD1-CE1 3.35Å; I166-F198 HydrophobicContact CD1-CE2 4.34Å; I166-F198 HydrophobicContact CD1-CG 4.35Å; I166-F198 HydrophobicContact CD1-CZ 3.7Å; I166-F198 HydrophobicContact CG1-CE1 4.46Å; I166-F198 HydrophobicContact CG2-CD2 3.87Å; I166-F198 HydrophobicContact CG2-CE1 4.38Å; I166-F198 HydrophobicContact CG2-CE2 3.37Å; I166-F198 HydrophobicContact CG2-CZ 3.67Å; I166-L210 HydrophobicContact CD1-CB 3.84Å; I166-L210 HydrophobicContact CD1-CD1 4.14Å; I166-L210 HydrophobicContact CG1-CD1 3.96Å; I166-C229 HydrophobicContact CG2-CB 3.93Å; I166-L231 HydrophobicContact CG1-CD1 4.35Å
167	G	89.5	Confident	86.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-124.2	175.5	0	0	0	0	0	111	C169 S181 D182 G185 N230	G167-C169 PolarHBondContact O-N 2.87Å; G167-S181 PolarHBondContact O-OG 3.04Å; G167-D182 CarbonylContact C-O 3.55Å; G167-D182 VanDerWaalsContact C-O 3.32Å; G167-G185 WeakPolarHBondContact O-CA 3.34Å; G167-N230 PolarHBondContact N-O 3.5Å
168	R	87.6	Confident	86.3	Confident	78 Å²	78	44.7 Å²	44.7	29%	0.294	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	130.1	-179.7	-169.5	-169	-60.9	-171.6	-2.1	111.6	W170 M179 S181 D182 D183 C229 N230	R168-W170 HydrophobicContact CG-CE3 4.45Å; R168-M179 HydrophobicContact CG-CE 4.48Å; R168-M179 HydrophobicContact CG-SD 3.5Å; R168-M179 WeakPolarHBondContact CG-SD 3.08Å; R168-S181 WeakPolarHBondContact CG-O 3.44Å; R168-D182 WeakPolarHBondContact CA-O 3.44Å; R168-D182 PolarHBondContact N-O 2.81Å; R168-D183 IonicContact CZ-OD1 3.64Å; R168-D183 IonicContact NE-OD1 3.8Å; R168-D183 PolarHBondContact NE-OD1 2.8Å; R168-D183 IonicContact NH2-OD1 3.36Å; R168-D183 PolarHBondContact NH2-OD1 2.81Å; R168-D183 IonicContact NH2-OD2 3.65Å; R168-D183 PolarHBondContact NH2-OD2 2.94Å; R168-C229 CarbonylContact O-C 3.1Å; R168-C229 WeakPolarHBondContact O-CA 3.4Å; R168-N230 PolarHBondContact O-N 3.11Å
169	C	91.5	Very high	86.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.8	170.6	-64.1	0	0	0	0	109.8	I166 G167 L180 S181 W195 L228 C229	I166-C169 WeakPolarHBondContact CG2-SG 3.3Å; G167-C169 PolarHBondContact O-N 2.87Å; C169-L180 HydrophobicContact CB-CB 4.18Å; C169-L180 HydrophobicContact CB-CD1 4.47Å; C169-L180 WeakPolarHBondContact O-CA 3.36Å; C169-L180 WeakPolarHBondContact O-CB 3.42Å; C169-L180 PolarHBondContact O-N 2.97Å; C169-S181 WeakPolarHBondContact CB-OG 3.35Å; C169-S181 PolarHBondContact N-OG 2.82Å; C169-S181 PolarHBondContact O-N 3.36Å; C169-S181 VanDerWaalsContact O-N 3.16Å; C169-W195 HydrophobicContact CB-CH2 4.43Å; C169-W195 HydrophobicContact CB-CZ2 3.75Å; C169-L228 CarbonylContact C-O 3.6Å; C169-L228 WeakPolarHBondContact CA-O 3.49Å; C169-C229 HydrophobicContact CB-CB 4.17Å; C169-C229 WeakPolarHBondContact CB-SG 3.38Å; C169-C229 WeakPolarHBondContact SG-CB 3.5Å; C169-C229 CovalentContact SG-SG 2.05Å; C169-C229 PolarHBondContact SG-SG 3.06Å
170	W	92.4	Very high	86.9	Confident	59 Å²	59	43.9 Å²	43.9	22%	0.223	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.7	174.4	67.1	97.6	0	0	0	109.9	R168 L178 M179 L228	R168-W170 HydrophobicContact CG-CE3 4.45Å; W170-L178 CarbonylContact C-O 3.59Å; W170-L178 VanDerWaalsContact CA-O 3.22Å; W170-L178 WeakPolarHBondContact CA-O 3.33Å; W170-L178 WeakPolarHBondContact CB-O 3.47Å; W170-M179 HydrophobicContact CB-CE 4.46Å; W170-M179 HydrophobicContact CB-SD 4.15Å; W170-L228 HydrophobicContact CD2-CB 4.08Å; W170-L228 HydrophobicContact CE3-CB 4.41Å; W170-L228 HydrophobicContact CH2-CB 3.88Å; W170-L228 HydrophobicContact CZ2-CB 3.49Å; W170-L228 VanDerWaalsContact CZ2-CB 3.49Å; W170-L228 HydrophobicContact CZ2-CD1 4.48Å; W170-L228 HydrophobicContact CZ2-CD2 4.09Å; W170-L228 HydrophobicContact CZ2-CG 4.22Å; W170-L228 HydrophobicContact CZ3-CB 4.31Å; W170-L228 PolarHBondContact N-O 3.18Å; W170-L228 PolarHBondContact O-N 2.81Å
171	A	90.4	Very high	87.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	142.9	169.6	0	0	0	0	0	110	N177 L178 L180 W217 F219 L225 N226	A171-N177 CarbonylContact O-C 3.54Å; A171-N177 WeakPolarHBondContact O-CA 3.46Å; A171-L178 PolarHBondContact N-O 3.33Å; A171-L178 PolarHBondContact O-N 3.06Å; A171-L180 HydrophobicContact CB-CD1 4.11Å; A171-L180 HydrophobicContact CB-CG 4.47Å; A171-W217 HydrophobicContact CB-CH2 3.57Å; A171-W217 HydrophobicContact CB-CZ2 3.37Å; A171-F219 HydrophobicContact CB-CE2 4.31Å; A171-F219 HydrophobicContact CB-CZ 4.36Å; A171-L225 HydrophobicContact CB-CD1 4.12Å; A171-L225 HydrophobicContact CB-CG 4.39Å; A171-N226 CarbonylContact C-O 3.45Å; A171-N226 WeakPolarHBondContact CA-O 3.36Å
172	S	85.2	Confident	87.7	Confident	23 Å²	23	44 Å²	44	16%	0.161	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	144.1	176.2	57.6	0	0	0	0	112.2	S176 N226 L228	S172-S176 VanDerWaalsContact CA-O 3.31Å; S172-S176 WeakPolarHBondContact CA-O 3.13Å; S172-N226 PolarHBondContact N-O 2.75Å; S172-N226 WeakPolarHBondContact O-CB 3.2Å; S172-N226 PolarHBondContact O-N 2.97Å; S172-N226 PolarHBondContact O-ND2 2.85Å; S172-L228 WeakPolarHBondContact OG-CD1 3.41Å
173	D	81.3	Confident	87.7	Confident	21 Å²	21	44.3 Å²	44.3	11%	0.112	21%	0.213	C	C	.	.			trans	-111.8	-151.3	159.6	71.8	0.9	0	0	0	109.3	F175 S176 F219 T221 S222 R224	D173-F175 PolarHBondContact OD1-N 3.48Å; D173-S176 PolarHBondContact N-O 2.94Å; D173-S176 VanDerWaalsContact N-O 3.15Å; D173-S176 WeakPolarHBondContact OD1-CA 3.4Å; D173-S176 VanDerWaalsContact OD1-CB 3.31Å; D173-S176 WeakPolarHBondContact OD1-CB 3.45Å; D173-S176 PolarHBondContact OD1-N 2.61Å; D173-F219 HydrophobicContact CB-CD2 4.03Å; D173-T221 WeakPolarHBondContact OD2-CB 3.31Å; D173-T221 PolarHBondContact OD2-OG1 2.97Å; D173-S222 WeakPolarHBondContact OD2-CB 3.35Å; D173-R224 WeakPolarHBondContact CB-O 3.25Å
174	E	80.6	Confident	87.6	Confident	156 Å²	156	46.4 Å²	46.4	73%	0.729	22%	0.224	S	C	*	.	S	Bend	trans	-75.2	-20.6	177.9	-64.6	-178.5	177.5	0	0	114
175	F	80.1	Confident	87.7	Confident	158 Å²	158	46.6 Å²	46.6	69%	0.693	23%	0.226	S	C	*	.	S	Bend	trans	-127.8	-27.1	-168.8	-57.5	-72.7	0	0	0	114	D173 T221	D173-F175 PolarHBondContact OD1-N 3.48Å; F175-T221 HydrophobicContact CB-CG2 4.48Å
176	S	80.1	Confident	87.9	Confident	33 Å²	33	44.9 Å²	44.9	23%	0.231	22%	0.223	C	C	.	.			trans	-119.8	144.9	-167.3	-60.5	0	0	0	0	110.4	S172 D173 T221	S172-S176 VanDerWaalsContact CA-O 3.31Å; S172-S176 WeakPolarHBondContact CA-O 3.13Å; D173-S176 PolarHBondContact N-O 2.94Å; D173-S176 VanDerWaalsContact N-O 3.15Å; D173-S176 WeakPolarHBondContact OD1-CA 3.4Å; D173-S176 VanDerWaalsContact OD1-CB 3.31Å; D173-S176 WeakPolarHBondContact OD1-CB 3.45Å; D173-S176 PolarHBondContact OD1-N 2.61Å; S176-T221 PolarHBondContact OG-OG1 2.91Å; S176-T221 VanDerWaalsContact OG-OG1 3.1Å
177	N	87.4	Confident	88.1	Confident	102 Å²	102	46 Å²	46	55%	0.545	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	135.1	173.8	-168.9	-51	0	0	0	109.1	A171	A171-N177 CarbonylContact O-C 3.54Å; A171-N177 WeakPolarHBondContact O-CA 3.46Å
178	L	87.3	Confident	88.2	Confident	51 Å²	51	49.6 Å²	49.6	27%	0.267	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	122.3	179.9	-178.7	64.1	0	0	0	110.4	W170 A171 L180 V191 I194 W217 F219	W170-L178 CarbonylContact C-O 3.59Å; W170-L178 VanDerWaalsContact CA-O 3.22Å; W170-L178 WeakPolarHBondContact CA-O 3.33Å; W170-L178 WeakPolarHBondContact CB-O 3.47Å; A171-L178 PolarHBondContact N-O 3.33Å; A171-L178 PolarHBondContact O-N 3.06Å; L178-L180 HydrophobicContact CD2-CD2 4.27Å; L178-L180 HydrophobicContact CG-CD2 4.4Å; L178-L180 PolarHBondContact O-N 3.15Å; L178-V191 HydrophobicContact CD1-CG1 4.15Å; L178-V191 HydrophobicContact CD2-CG1 3.93Å; L178-V191 HydrophobicContact CG-CG1 4.28Å; L178-I194 HydrophobicContact CD2-CD1 4.34Å; L178-W217 HydrophobicContact CB-CH2 4.2Å; L178-W217 HydrophobicContact CD2-CH2 3.53Å; L178-W217 HydrophobicContact CD2-CZ2 3.74Å; L178-W217 HydrophobicContact CD2-CZ3 4.11Å; L178-F219 HydrophobicContact CB-CE1 3.9Å; L178-F219 HydrophobicContact CB-CZ 3.72Å
179	M	91.4	Very high	88	Confident	65 Å²	65	54.2 Å²	54.2	32%	0.32	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.3	173.5	-162	61.9	58.8	0	0	110.5	R168 W170 M188	R168-M179 HydrophobicContact CG-CE 4.48Å; R168-M179 HydrophobicContact CG-SD 3.5Å; R168-M179 WeakPolarHBondContact CG-SD 3.08Å; W170-M179 HydrophobicContact CB-CE 4.46Å; W170-M179 HydrophobicContact CB-SD 4.15Å; M179-M188 HydrophobicContact CB-CG 4.17Å; M179-M188 HydrophobicContact CG-CG 3.88Å; M179-M188 HydrophobicContact CG-SD 4.16Å
180	L	94.5	Very high	87.7	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-40.3	-178.2	-60.1	173.1	0	0	0	111.8	C169 A171 L178 P187 M188 W195 W217 I227	C169-L180 HydrophobicContact CB-CB 4.18Å; C169-L180 HydrophobicContact CB-CD1 4.47Å; C169-L180 WeakPolarHBondContact O-CA 3.36Å; C169-L180 WeakPolarHBondContact O-CB 3.42Å; C169-L180 PolarHBondContact O-N 2.97Å; A171-L180 HydrophobicContact CB-CD1 4.11Å; A171-L180 HydrophobicContact CB-CG 4.47Å; L178-L180 HydrophobicContact CD2-CD2 4.27Å; L178-L180 HydrophobicContact CG-CD2 4.4Å; L178-L180 PolarHBondContact O-N 3.15Å; L180-P187 WeakPolarHBondContact O-CA 3.46Å; L180-M188 PolarHBondContact O-N 3.04Å; L180-W195 HydrophobicContact CB-CB 4.46Å; L180-W195 HydrophobicContact CB-CD2 3.86Å; L180-W195 HydrophobicContact CB-CE3 4.46Å; L180-W195 HydrophobicContact CB-CG 3.85Å; L180-W195 HydrophobicContact CD1-CD2 3.97Å; L180-W195 HydrophobicContact CD1-CE3 3.73Å; L180-W195 HydrophobicContact CD1-CH2 4.2Å; L180-W195 HydrophobicContact CD1-CZ2 4.41Å; L180-W195 HydrophobicContact CD1-CZ3 3.84Å; L180-W195 HydrophobicContact CD2-CB 4.38Å; L180-W195 HydrophobicContact CG-CD2 4.35Å; L180-W195 HydrophobicContact CG-CE3 4.49Å; L180-W217 HydrophobicContact CD2-CZ2 4.25Å; L180-I227 HydrophobicContact CD1-CG2 4.16Å
181	S	93	Very high	87.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	156	175.9	56.7	0	0	0	0	112.6	G167 R168 C169 C186	G167-S181 PolarHBondContact O-OG 3.04Å; R168-S181 WeakPolarHBondContact CG-O 3.44Å; C169-S181 WeakPolarHBondContact CB-OG 3.35Å; C169-S181 PolarHBondContact N-OG 2.82Å; C169-S181 PolarHBondContact O-N 3.36Å; C169-S181 VanDerWaalsContact O-N 3.16Å; S181-C186 CarbonylContact C-O 3.58Å; S181-C186 WeakPolarHBondContact CA-O 3.49Å; S181-C186 VanDerWaalsContact CB-O 3.32Å; S181-C186 WeakPolarHBondContact CB-O 3.47Å
182	D	87.7	Confident	87.2	Confident	54 Å²	54	63.5 Å²	63.5	29%	0.289	33%	0.333	S	S	.	.			trans	-78.5	-176.8	174	74.6	5	0	0	0	113	G167 R168 N184 G185 C186 M188	G167-D182 CarbonylContact C-O 3.55Å; G167-D182 VanDerWaalsContact C-O 3.32Å; R168-D182 WeakPolarHBondContact CA-O 3.44Å; R168-D182 PolarHBondContact N-O 2.81Å; D182-N184 PolarHBondContact O-N 3.47Å; D182-N184 WeakPolarHBondContact OD1-CA 3.46Å; D182-N184 WeakPolarHBondContact OD1-CB 3.47Å; D182-N184 PolarHBondContact OD1-N 2.9Å; D182-G185 PolarHBondContact O-N 3.01Å; D182-G185 PolarHBondContact OD1-N 3.44Å; D182-C186 PolarHBondContact N-O 3.26Å; D182-C186 PolarHBondContact OD1-N 2.96Å; D182-M188 HydrophobicContact CB-SD 4.37Å
183	D	85.9	Confident	87.4	Confident	42 Å²	42	67.1 Å²	67.1	23%	0.225	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.7	178.8	-71.7	-23.5	0	0	0	114.6	Q15 R165 R168	Q15-D183 PolarHBondContact NE2-OD2 3.32Å; R165-D183 PolarHBondContact NH1-O 2.63Å; R165-D183 PolarHBondContact NH2-O 2.86Å; R168-D183 IonicContact CZ-OD1 3.64Å; R168-D183 IonicContact NE-OD1 3.8Å; R168-D183 PolarHBondContact NE-OD1 2.8Å; R168-D183 IonicContact NH2-OD1 3.36Å; R168-D183 PolarHBondContact NH2-OD1 2.81Å; R168-D183 IonicContact NH2-OD2 3.65Å; R168-D183 PolarHBondContact NH2-OD2 2.94Å
184	N	86.3	Confident	88	Confident	70 Å²	70	67.6 Å²	67.6	37%	0.374	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.6	176.8	-61.4	-47	0	0	0	112.2	R165 D182 L241	R165-N184 PolarHBondContact NH1-O 3.27Å; D182-N184 PolarHBondContact O-N 3.47Å; D182-N184 WeakPolarHBondContact OD1-CA 3.46Å; D182-N184 WeakPolarHBondContact OD1-CB 3.47Å; D182-N184 PolarHBondContact OD1-N 2.9Å; N184-L241 HydrophobicContact CB-CB 4.31Å; N184-L241 HydrophobicContact CB-CD1 4.3Å; N184-L241 WeakPolarHBondContact OD1-CD1 3.48Å
185	G	89.4	Confident	88.8	Confident	5 Å²	5	60.2 Å²	60.2	5%	0.052	33%	0.326	C	S	.	.	S	Bend	trans	92.2	9.8	-176.1	0	0	0	0	0	113.3	G167 D182	G167-G185 WeakPolarHBondContact O-CA 3.34Å; D182-G185 PolarHBondContact O-N 3.01Å; D182-G185 PolarHBondContact OD1-N 3.44Å
186	C	93.1	Very high	89.5	Confident	19 Å²	19	54.2 Å²	54.2	13%	0.128	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-82.3	133.2	-177.4	-53.9	0	0	0	0	110.8	S181 D182 M188 C242	S181-C186 CarbonylContact C-O 3.58Å; S181-C186 WeakPolarHBondContact CA-O 3.49Å; S181-C186 VanDerWaalsContact CB-O 3.32Å; S181-C186 WeakPolarHBondContact CB-O 3.47Å; D182-C186 PolarHBondContact N-O 3.26Å; D182-C186 PolarHBondContact OD1-N 2.96Å; C186-M188 PolarHBondContact O-N 2.71Å; C186-C242 WeakPolarHBondContact CA-SG 3.44Å; C186-C242 HydrophobicContact CB-CB 3.9Å; C186-C242 WeakPolarHBondContact CB-SG 3.4Å; C186-C242 WeakPolarHBondContact SG-CA 3.48Å; C186-C242 WeakPolarHBondContact SG-CB 3.45Å; C186-C242 CovalentContact SG-SG 2.05Å; C186-C242 PolarHBondContact SG-SG 2.77Å
187	P	94.7	Very high	90.1	Very high	29 Å²	29	55.5 Å²	55.5	19%	0.188	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-59.4	134.4	179.8	-25.2	34.5	0	0	0	112.4	L180 H189 W195 S196 E197	L180-P187 WeakPolarHBondContact O-CA 3.46Å; P187-H189 PolarHBondContact O-N 3.19Å; P187-W195 WeakPolarHBondContact CB-O 3.18Å; P187-S196 VanDerWaalsContact CG-C 3.47Å; P187-E197 HydrophobicContact CG-CB 4.12Å; P187-E197 VanDerWaalsContact CG-N 3.29Å
188	M	92.1	Very high	90.4	Very high	76 Å²	76	51.8 Å²	51.8	37%	0.374	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-64.5	135.3	174	-64.6	-63.4	-68.2	0	0	109.6	M179 L180 D182 C186 A190 V191 K192	M179-M188 HydrophobicContact CB-CG 4.17Å; M179-M188 HydrophobicContact CG-CG 3.88Å; M179-M188 HydrophobicContact CG-SD 4.16Å; L180-M188 PolarHBondContact O-N 3.04Å; D182-M188 HydrophobicContact CB-SD 4.37Å; C186-M188 PolarHBondContact O-N 2.71Å; M188-A190 PolarHBondContact O-N 2.8Å; M188-A190 VanDerWaalsContact O-N 3.13Å; M188-V191 HydrophobicContact CB-CG2 3.67Å; M188-V191 WeakPolarHBondContact O-CG2 3.16Å; M188-V191 PolarHBondContact O-N 3.49Å; M188-K192 PolarHBondContact O-N 2.93Å
189	H	83.8	Confident	90.7	Very high	176 Å²	176	52.6 Å²	52.6	82%	0.815	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-53.6	-39.9	-174.1	-177.7	-90	0	0	0	113.2	P187 V191	P187-H189 PolarHBondContact O-N 3.19Å; H189-V191 PolarHBondContact O-N 3.43Å
190	A	84.8	Confident	90.9	Very high	92 Å²	92	53.4 Å²	53.4	76%	0.76	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-63.2	-21	-178.7	0	0	0	0	0	114.3	M188	M188-A190 PolarHBondContact O-N 2.8Å; M188-A190 VanDerWaalsContact O-N 3.13Å
191	V	88.3	Confident	90.9	Very high	10 Å²	10	55.2 Å²	55.2	6%	0.061	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-127.5	14.2	-171	-66.7	0	0	0	0	112.3	L178 M188 H189 S193 I194 W195	L178-V191 HydrophobicContact CD1-CG1 4.15Å; L178-V191 HydrophobicContact CD2-CG1 3.93Å; L178-V191 HydrophobicContact CG-CG1 4.28Å; M188-V191 HydrophobicContact CB-CG2 3.67Å; M188-V191 WeakPolarHBondContact O-CG2 3.16Å; M188-V191 PolarHBondContact O-N 3.49Å; H189-V191 PolarHBondContact O-N 3.43Å; V191-S193 PolarHBondContact O-N 3.44Å; V191-S193 VanDerWaalsContact O-N 3.07Å; V191-I194 HydrophobicContact CB-CD1 3.68Å; V191-I194 HydrophobicContact CB-CG1 3.51Å; V191-I194 HydrophobicContact CG1-CD1 3.64Å; V191-I194 HydrophobicContact CG1-CG1 4.06Å; V191-I194 WeakPolarHBondContact O-CG1 3.22Å; V191-I194 PolarHBondContact O-N 2.76Å; V191-W195 PolarHBondContact O-N 2.99Å
192	K	84.8	Confident	90.9	Very high	152 Å²	152	59.5 Å²	59.5	66%	0.661	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.7	180	-168.2	174.1	-178	177.1	0	113.4	M188	M188-K192 PolarHBondContact O-N 2.93Å
193	S	89.8	Confident	91.1	Very high	99 Å²	99	60.5 Å²	60.5	69%	0.692	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-17.4	175.2	57.9	0	0	0	0	114.2	V191	V191-S193 PolarHBondContact O-N 3.44Å; V191-S193 VanDerWaalsContact O-N 3.07Å
194	I	93.4	Very high	91.3	Very high	31 Å²	31	63 Å²	63	16%	0.159	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-22.5	-178.8	64.5	169.6	0	0	0	113.2	L178 V191 I214 K215 W217	L178-I194 HydrophobicContact CD2-CD1 4.34Å; V191-I194 HydrophobicContact CB-CD1 3.68Å; V191-I194 HydrophobicContact CB-CG1 3.51Å; V191-I194 HydrophobicContact CG1-CD1 3.64Å; V191-I194 HydrophobicContact CG1-CG1 4.06Å; V191-I194 WeakPolarHBondContact O-CG1 3.22Å; V191-I194 PolarHBondContact O-N 2.76Å; I194-I214 VanDerWaalsContact O-CA 3.26Å; I194-I214 WeakPolarHBondContact O-CA 3.25Å; I194-K215 PolarHBondContact O-N 3.28Å; I194-W217 HydrophobicContact CD1-CD2 4.29Å; I194-W217 HydrophobicContact CD1-CG 4.14Å
195	W	96.1	Very high	91.3	Very high	1 Å²	1	67.3 Å²	67.3	0%	0.004	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-135.1	113.9	-177.1	-172.5	-95.5	0	0	0	109.9	Y152 C169 L180 P187 V191 F198 N212 I214 I227	Y152-W195 HydrophobicContact CD2-CH2 4.38Å; Y152-W195 HydrophobicContact CG-CH2 4.28Å; C169-W195 HydrophobicContact CB-CH2 4.43Å; C169-W195 HydrophobicContact CB-CZ2 3.75Å; L180-W195 HydrophobicContact CB-CB 4.46Å; L180-W195 HydrophobicContact CB-CD2 3.86Å; L180-W195 HydrophobicContact CB-CE3 4.46Å; L180-W195 HydrophobicContact CB-CG 3.85Å; L180-W195 HydrophobicContact CD1-CD2 3.97Å; L180-W195 HydrophobicContact CD1-CE3 3.73Å; L180-W195 HydrophobicContact CD1-CH2 4.2Å; L180-W195 HydrophobicContact CD1-CZ2 4.41Å; L180-W195 HydrophobicContact CD1-CZ3 3.84Å; L180-W195 HydrophobicContact CD2-CB 4.38Å; L180-W195 HydrophobicContact CG-CD2 4.35Å; L180-W195 HydrophobicContact CG-CE3 4.49Å; P187-W195 WeakPolarHBondContact CB-O 3.18Å; V191-W195 PolarHBondContact O-N 2.99Å; W195-F198 HydrophobicContact CH2-CZ 4.12Å; W195-F198 AromaticContact CZ2-CE2 3.64Å; W195-F198 HydrophobicContact CZ2-CE2 3.64Å; W195-F198 AromaticContact CZ2-CZ 3.53Å; W195-F198 HydrophobicContact CZ2-CZ 3.53Å; W195-N212 VanDerWaalsContact CZ2-ND2 3.26Å; W195-N212 WeakPolarHBondContact CZ2-ND2 3.31Å; W195-N212 PolarHBondContact NE1-ND2 3.08Å; W195-I214 HydrophobicContact CE3-CD1 3.95Å; W195-I214 HydrophobicContact CE3-CG1 3.78Å; W195-I214 HydrophobicContact CH2-CD1 4.33Å; W195-I214 HydrophobicContact CZ3-CD1 3.43Å; W195-I214 VanDerWaalsContact CZ3-CD1 3.43Å; W195-I214 HydrophobicContact CZ3-CG1 3.79Å; W195-I227 HydrophobicContact CH2-CG2 3.8Å; W195-I227 HydrophobicContact CZ3-CD1 4.24Å; W195-I227 HydrophobicContact CZ3-CG2 4.01Å
196	S	94.8	Very high	91.3	Very high	32 Å²	32	70.9 Å²	70.9	22%	0.224	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-89.7	170.3	176.2	84.2	0	0	0	0	112.4	P187 N212 K213	P187-S196 VanDerWaalsContact CG-C 3.47Å; S196-N212 WeakPolarHBondContact O-CB 3.4Å; S196-N212 PolarHBondContact O-ND2 3.1Å; S196-K213 PolarHBondContact N-O 2.76Å; S196-K213 PolarHBondContact OG-N 3.1Å
197	E	93.4	Very high	91.4	Very high	59 Å²	59	72.1 Å²	72.1	28%	0.276	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-62.6	154.9	167.9	-168.8	173.1	165	0	0	111.4	P187 N212 N240 C242	P187-E197 HydrophobicContact CG-CB 4.12Å; P187-E197 VanDerWaalsContact CG-N 3.29Å; E197-N212 WeakPolarHBondContact O-CB 3.42Å; E197-N240 VanDerWaalsContact OE1-CG 3.24Å; E197-N240 PolarHBondContact OE1-ND2 3.37Å; E197-N240 PolarHBondContact OE1-OD1 3.28Å; E197-C242 WeakPolarHBondContact OE1-CB 3.5Å
198	F	94.1	Very high	91.4	Very high	24 Å²	24	70.7 Å²	70.7	11%	0.105	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-82.9	124.8	177.7	-79.7	-83.5	0	0	0	111.9	Y152 I166 W195 L210 Y211 N212	Y152-F198 AromaticContact CD1-CE1 3.82Å; Y152-F198 HydrophobicContact CD1-CE1 3.82Å; Y152-F198 HydrophobicContact CD1-CZ 4.06Å; Y152-F198 HydrophobicContact CE1-CE1 4.48Å; I166-F198 HydrophobicContact CB-CD1 4.41Å; I166-F198 HydrophobicContact CB-CD2 3.96Å; I166-F198 HydrophobicContact CB-CE1 4.4Å; I166-F198 HydrophobicContact CB-CE2 3.92Å; I166-F198 HydrophobicContact CB-CG 4.2Å; I166-F198 HydrophobicContact CB-CZ 4.15Å; I166-F198 HydrophobicContact CD1-CD1 3.71Å; I166-F198 HydrophobicContact CD1-CE1 3.35Å; I166-F198 HydrophobicContact CD1-CE2 4.34Å; I166-F198 HydrophobicContact CD1-CG 4.35Å; I166-F198 HydrophobicContact CD1-CZ 3.7Å; I166-F198 HydrophobicContact CG1-CE1 4.46Å; I166-F198 HydrophobicContact CG2-CD2 3.87Å; I166-F198 HydrophobicContact CG2-CE1 4.38Å; I166-F198 HydrophobicContact CG2-CE2 3.37Å; I166-F198 HydrophobicContact CG2-CZ 3.67Å; W195-F198 HydrophobicContact CH2-CZ 4.12Å; W195-F198 AromaticContact CZ2-CE2 3.64Å; W195-F198 HydrophobicContact CZ2-CE2 3.64Å; W195-F198 AromaticContact CZ2-CZ 3.53Å; W195-F198 HydrophobicContact CZ2-CZ 3.53Å; F198-L210 HydrophobicContact CD1-CB 4.44Å; F198-Y211 CarbonylContact C-O 3.52Å; F198-Y211 WeakPolarHBondContact CA-O 3.29Å; F198-N212 HydrophobicContact CD1-CB 3.87Å; F198-N212 HydrophobicContact CD2-CB 4.46Å; F198-N212 HydrophobicContact CE1-CB 3.92Å; F198-N212 HydrophobicContact CG-CB 4.14Å; F198-N212 HydrophobicContact CZ-CB 4.27Å
199	D	94.1	Very high	91.6	Very high	69 Å²	69	67.1 Å²	67.1	37%	0.369	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	149.8	163.4	-67.8	-46.4	0	0	0	109.9	L210 Y211	D199-L210 WeakPolarHBondContact O-CA 3.35Å; D199-Y211 HydrophobicContact CB-CD1 4.19Å; D199-Y211 HydrophobicContact CB-CE1 3.61Å; D199-Y211 HydrophobicContact CB-CE2 4.06Å; D199-Y211 PolarHBondContact N-O 3.25Å; D199-Y211 PolarHBondContact O-N 3.12Å; D199-Y211 WeakPolarHBondContact OD2-CE2 3.48Å; D199-Y211 PolarHBondContact OD2-OH 3.35Å
200	K	93.8	Very high	92.2	Very high	82 Å²	82	59 Å²	59	36%	0.357	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	128.1	174.7	-176.2	173.4	-174.6	160.7	0	110.3	A161 S162 V164 L210	A161-K200 PolarHBondContact O-NZ 3.04Å; S162-K200 VanDerWaalsContact C-NZ 3.27Å; S162-K200 PolarHBondContact O-NZ 2.76Å; V164-K200 PolarHBondContact O-NZ 2.98Å; K200-L210 HydrophobicContact CB-CD2 3.67Å; K200-L210 HydrophobicContact CD-CD2 3.93Å; K200-L210 HydrophobicContact CG-CD2 3.66Å
201	V	94.4	Very high	92.8	Very high	37 Å²	37	56.2 Å²	56.2	22%	0.224	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.1	174.9	-176.5	0	0	0	0	109.4	Y135 L203 V208 V209 Y211	Y135-V201 HydrophobicContact CD1-CG2 4.48Å; Y135-V201 HydrophobicContact CE1-CB 4.27Å; Y135-V201 HydrophobicContact CE1-CG1 4.41Å; Y135-V201 HydrophobicContact CE1-CG2 3.79Å; V201-L203 HydrophobicContact CG1-CD2 4.15Å; V201-V208 CarbonylContact O-C 3.59Å; V201-V208 WeakPolarHBondContact O-CA 3.29Å; V201-V209 PolarHBondContact N-O 3.39Å; V201-V209 PolarHBondContact O-N 2.93Å; V201-Y211 HydrophobicContact CG2-CD1 4.47Å; V201-Y211 HydrophobicContact CG2-CE1 3.82Å
202	Q	93.8	Very high	93.2	Very high	91 Å²	91	55.7 Å²	55.7	43%	0.425	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.8	170.5	-164.9	77.5	42.6	0	0	108.2	D204 H205 E207 V208	Q202-D204 PolarHBondContact NE2-O 2.93Å; Q202-H205 PolarHBondContact NE2-O 2.67Å; Q202-E207 PolarHBondContact NE2-O 2.93Å; Q202-V208 VanDerWaalsContact CD-CG1 3.42Å; Q202-V208 VanDerWaalsContact NE2-CG1 3.27Å
203	L	92.6	Very high	93.7	Very high	74 Å²	74	53.1 Å²	53.1	39%	0.387	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-42.1	176.2	-64.1	-174.5	0	0	0	111.5	Y135 V201 E207 V209	Y135-L203 HydrophobicContact CE2-CD2 4.06Å; V201-L203 HydrophobicContact CG1-CD2 4.15Å; L203-E207 HydrophobicContact CB-CB 4.42Å; L203-E207 HydrophobicContact CB-CG 4.37Å; L203-E207 HydrophobicContact CD1-CG 4.26Å; L203-E207 PolarHBondContact N-O 3.05Å; L203-V209 HydrophobicContact CD1-CG2 3.41Å; L203-V209 VanDerWaalsContact CD1-CG2 3.41Å; L203-V209 HydrophobicContact CD2-CG2 4.42Å; L203-V209 HydrophobicContact CG-CG2 3.82Å
204	D	90.2	Very high	94	Very high	96 Å²	96	48.9 Å²	48.9	51%	0.513	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	170.3	176.8	-166.6	1.1	0	0	0	108.5	Q202 D206 E207	Q202-D204 PolarHBondContact NE2-O 2.93Å; D204-D206 PolarHBondContact O-N 2.83Å; D204-D206 VanDerWaalsContact O-N 3.08Å; D204-E207 HydrophobicContact CB-CB 4.39Å; D204-E207 PolarHBondContact N-O 2.95Å; D204-E207 PolarHBondContact O-N 2.6Å
205	H	86.2	Confident	94.1	Very high	159 Å²	159	52.9 Å²	52.9	74%	0.736	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-40.9	-177.6	-62.6	80.8	0	0	0	113.4	Q202	Q202-H205 PolarHBondContact NE2-O 2.67Å
206	D	89.8	Confident	94	Very high	81 Å²	81	53.3 Å²	53.3	43%	0.433	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	10.2	-178.8	-68.2	-32.8	0	0	0	113.2	R157 G158 A161 D204	R157-D206 CarbonylContact C-O 3.36Å; R157-D206 WeakPolarHBondContact CA-O 3.4Å; G158-D206 PolarHBondContact N-O 3.04Å; A161-D206 WeakPolarHBondContact CB-O 3.5Å; D204-D206 PolarHBondContact O-N 2.83Å; D204-D206 VanDerWaalsContact O-N 3.08Å
207	E	94.2	Very high	93.9	Very high	44 Å²	44	53.9 Å²	53.9	21%	0.206	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	122.9	180	-170.1	173.2	165.7	0	0	112.4	R155 V156 Q202 L203 D204	R155-E207 IonicContact NH1-OE1 3.4Å; V156-E207 WeakPolarHBondContact O-CA 3.19Å; Q202-E207 PolarHBondContact NE2-O 2.93Å; L203-E207 HydrophobicContact CB-CB 4.42Å; L203-E207 HydrophobicContact CB-CG 4.37Å; L203-E207 HydrophobicContact CD1-CG 4.26Å; L203-E207 PolarHBondContact N-O 3.05Å; D204-E207 HydrophobicContact CB-CB 4.39Å; D204-E207 PolarHBondContact N-O 2.95Å; D204-E207 PolarHBondContact O-N 2.6Å
208	V	94.9	Very high	93.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	152.9	172.7	-55.9	0	0	0	0	111.6	V156 A161 V164 V201 Q202	V156-V208 HydrophobicContact CB-CG2 3.85Å; V156-V208 HydrophobicContact CG2-CG2 4.3Å; V156-V208 PolarHBondContact N-O 2.8Å; V156-V208 PolarHBondContact O-N 3.13Å; A161-V208 HydrophobicContact CB-CG1 4.31Å; A161-V208 HydrophobicContact CB-CG2 4.16Å; A161-V208 WeakPolarHBondContact O-CG1 3.29Å; A161-V208 VanDerWaalsContact O-CG2 3.24Å; A161-V208 WeakPolarHBondContact O-CG2 3.34Å; V164-V208 HydrophobicContact CG2-CG2 3.66Å; V201-V208 CarbonylContact O-C 3.59Å; V201-V208 WeakPolarHBondContact O-CA 3.29Å; Q202-V208 VanDerWaalsContact CD-CG1 3.42Å; Q202-V208 VanDerWaalsContact NE2-CG1 3.27Å
209	V	96.4	Very high	93.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.3	168.5	-177.1	0	0	0	0	108.8	Y135 V153 A154 R155 V201 L203 Y211	Y135-V209 HydrophobicContact CD1-CG1 4.49Å; Y135-V209 HydrophobicContact CD2-CB 4.44Å; Y135-V209 HydrophobicContact CD2-CG1 4.07Å; Y135-V209 HydrophobicContact CD2-CG2 4.36Å; Y135-V209 HydrophobicContact CG-CG1 3.81Å; V153-V209 HydrophobicContact CG1-CG1 3.66Å; A154-V209 WeakPolarHBondContact O-CA 3.15Å; R155-V209 HydrophobicContact CG-CG2 4.19Å; V201-V209 PolarHBondContact N-O 3.39Å; V201-V209 PolarHBondContact O-N 2.93Å; L203-V209 HydrophobicContact CD1-CG2 3.41Å; L203-V209 VanDerWaalsContact CD1-CG2 3.41Å; L203-V209 HydrophobicContact CD2-CG2 4.42Å; L203-V209 HydrophobicContact CG-CG2 3.82Å; V209-Y211 HydrophobicContact CG1-CD1 4.48Å
210	L	95.9	Very high	92.8	Very high	5 Å²	5	57 Å²	57	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.5	168.2	-63.7	164.9	0	0	0	107	A154 V164 I166 F198 D199 K200 L231	A154-L210 HydrophobicContact CB-CB 4.35Å; A154-L210 PolarHBondContact N-O 2.91Å; A154-L210 PolarHBondContact O-N 2.92Å; V164-L210 HydrophobicContact CG2-CD1 3.83Å; I166-L210 HydrophobicContact CD1-CB 3.84Å; I166-L210 HydrophobicContact CD1-CD1 4.14Å; I166-L210 HydrophobicContact CG1-CD1 3.96Å; F198-L210 HydrophobicContact CD1-CB 4.44Å; D199-L210 WeakPolarHBondContact O-CA 3.35Å; K200-L210 HydrophobicContact CB-CD2 3.67Å; K200-L210 HydrophobicContact CD-CD2 3.93Å; K200-L210 HydrophobicContact CG-CD2 3.66Å; L210-L231 HydrophobicContact CD1-CD1 4.24Å
211	Y	97.2	Very high	92	Very high	34 Å²	34	56.6 Å²	56.6	13%	0.133	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	154.4	177.4	76.3	-87.1	0	0	0	112.4	Y135 Y152 F198 D199 V201 V209	Y135-Y211 AromaticContact CD1-CD1 3.42Å; Y135-Y211 HydrophobicContact CD1-CD1 3.42Å; Y135-Y211 VanDerWaalsContact CD1-CD1 3.42Å; Y135-Y211 AromaticContact CD1-CE1 3.43Å; Y135-Y211 HydrophobicContact CD1-CE1 3.43Å; Y135-Y211 VanDerWaalsContact CD1-CE1 3.43Å; Y135-Y211 HydrophobicContact CD1-CG 4.17Å; Y135-Y211 HydrophobicContact CE1-CD1 4.26Å; Y135-Y211 AromaticContact CE1-CE1 3.89Å; Y135-Y211 HydrophobicContact CE1-CE1 3.89Å; Y135-Y211 HydrophobicContact CG-CD1 4.11Å; Y152-Y211 WeakPolarHBondContact O-CA 3.48Å; Y152-Y211 WeakPolarHBondContact O-CB 3.48Å; F198-Y211 CarbonylContact C-O 3.52Å; F198-Y211 WeakPolarHBondContact CA-O 3.29Å; D199-Y211 HydrophobicContact CB-CD1 4.19Å; D199-Y211 HydrophobicContact CB-CE1 3.61Å; D199-Y211 HydrophobicContact CB-CE2 4.06Å; D199-Y211 PolarHBondContact N-O 3.25Å; D199-Y211 PolarHBondContact O-N 3.12Å; D199-Y211 WeakPolarHBondContact OD2-CE2 3.48Å; D199-Y211 PolarHBondContact OD2-OH 3.35Å; V201-Y211 HydrophobicContact CG2-CD1 4.47Å; V201-Y211 HydrophobicContact CG2-CE1 3.82Å; V209-Y211 HydrophobicContact CG1-CD1 4.48Å
212	N	96.4	Very high	91.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	172.1	169.6	81.3	-25.5	0	0	0	110.5	S151 Y152 W195 S196 E197 F198	S151-N212 WeakPolarHBondContact CA-O 3.32Å; S151-N212 WeakPolarHBondContact CB-O 2.98Å; S151-N212 PolarHBondContact OG-O 2.87Å; Y152-N212 WeakPolarHBondContact CB-OD1 3.36Å; Y152-N212 PolarHBondContact N-O 3.5Å; Y152-N212 PolarHBondContact N-OD1 2.91Å; Y152-N212 PolarHBondContact O-N 2.03Å; Y152-N212 VanDerWaalsContact O-N 3.12Å; W195-N212 VanDerWaalsContact CZ2-ND2 3.26Å; W195-N212 WeakPolarHBondContact CZ2-ND2 3.31Å; W195-N212 PolarHBondContact NE1-ND2 3.08Å; S196-N212 WeakPolarHBondContact O-CB 3.4Å; S196-N212 PolarHBondContact O-ND2 3.1Å; E197-N212 WeakPolarHBondContact O-CB 3.42Å; F198-N212 HydrophobicContact CD1-CB 3.87Å; F198-N212 HydrophobicContact CD2-CB 4.46Å; F198-N212 HydrophobicContact CE1-CB 3.92Å; F198-N212 HydrophobicContact CG-CB 4.14Å; F198-N212 HydrophobicContact CZ-CB 4.27Å
213	K	96.8	Very high	90.6	Very high	98 Å²	98	58.8 Å²	58.8	43%	0.426	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	135.4	176.6	-58.8	169.4	-170.5	167.4	0	109.3	N133 S196	N133-K213 HydrophobicContact CB-CD 4.47Å; N133-K213 HydrophobicContact CB-CG 4.44Å; S196-K213 PolarHBondContact N-O 2.76Å; S196-K213 PolarHBondContact OG-N 3.1Å
214	I	96	Very high	90	Very high	10 Å²	10	63.9 Å²	63.9	5%	0.051	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.5	-178.9	-58.8	175	0	0	0	108.6	I129 L150 I194 W195 I227	I129-I214 HydrophobicContact CD1-CD1 4.26Å; L150-I214 HydrophobicContact CB-CB 4.05Å; L150-I214 HydrophobicContact CB-CG2 4.43Å; L150-I214 PolarHBondContact N-O 2.91Å; L150-I214 PolarHBondContact O-N 2.83Å; L150-I214 VanDerWaalsContact O-O 3.08Å; I194-I214 VanDerWaalsContact O-CA 3.26Å; I194-I214 WeakPolarHBondContact O-CA 3.25Å; W195-I214 HydrophobicContact CE3-CD1 3.95Å; W195-I214 HydrophobicContact CE3-CG1 3.78Å; W195-I214 HydrophobicContact CH2-CD1 4.33Å; W195-I214 HydrophobicContact CZ3-CD1 3.43Å; W195-I214 VanDerWaalsContact CZ3-CD1 3.43Å; W195-I214 HydrophobicContact CZ3-CG1 3.79Å; I214-I227 HydrophobicContact CD1-CD1 4.31Å
215	K	94.9	Very high	89.7	Confident	114 Å²	114	61.9 Å²	61.9	50%	0.496	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.6	162.7	-169.8	171.1	-175.8	176.9	0	108.2	G147 I194 W217	G147-K215 VanDerWaalsContact CA-CE 3.5Å; G147-K215 WeakPolarHBondContact O-CE 3.49Å; I194-K215 PolarHBondContact O-N 3.28Å; K215-W217 PolarHBondContact O-N 3.32Å
216	A	93.2	Very high	89.7	Confident	10 Å²	10	58.9 Å²	58.9	8%	0.083	30%	0.304	C	S	.	.			trans	-52.9	134.1	-174.3	0	0	0	0	0	111.5	N145 G147 E148 L150	N145-A216 VanDerWaalsContact O-CB 3.26Å; N145-A216 WeakPolarHBondContact O-CB 3.02Å; G147-A216 PolarHBondContact N-O 2.9Å; E148-A216 HydrophobicContact CB-CB 4.02Å; E148-A216 WeakPolarHBondContact O-CB 3.26Å; E148-A216 PolarHBondContact O-N 3.05Å; L150-A216 HydrophobicContact CD1-CB 3.74Å; L150-A216 HydrophobicContact CG-CB 4.35Å
217	W	92.8	Very high	89.9	Confident	44 Å²	44	56.6 Å²	56.6	17%	0.167	29%	0.291	C	S	.	.			trans	-150	162.4	-178	68.3	-88.2	0	0	0	109.1	A171 L178 L180 I194 K215 F219 L225	A171-W217 HydrophobicContact CB-CH2 3.57Å; A171-W217 HydrophobicContact CB-CZ2 3.37Å; L178-W217 HydrophobicContact CB-CH2 4.2Å; L178-W217 HydrophobicContact CD2-CH2 3.53Å; L178-W217 HydrophobicContact CD2-CZ2 3.74Å; L178-W217 HydrophobicContact CD2-CZ3 4.11Å; L180-W217 HydrophobicContact CD2-CZ2 4.25Å; I194-W217 HydrophobicContact CD1-CD2 4.29Å; I194-W217 HydrophobicContact CD1-CG 4.14Å; K215-W217 PolarHBondContact O-N 3.32Å; W217-F219 HydrophobicContact CH2-CD1 4.21Å; W217-F219 HydrophobicContact CH2-CD2 4.13Å; W217-F219 AromaticContact CH2-CE1 3.7Å; W217-F219 HydrophobicContact CH2-CE1 3.7Å; W217-F219 AromaticContact CH2-CE2 3.62Å; W217-F219 HydrophobicContact CH2-CE2 3.62Å; W217-F219 HydrophobicContact CH2-CG 4.41Å; W217-F219 AromaticContact CH2-CZ 3.4Å; W217-F219 HydrophobicContact CH2-CZ 3.4Å; W217-F219 VanDerWaalsContact CH2-CZ 3.4Å; W217-F219 AromaticContact CZ3-CD1 3.65Å; W217-F219 HydrophobicContact CZ3-CD1 3.65Å; W217-F219 AromaticContact CZ3-CD2 3.9Å; W217-F219 HydrophobicContact CZ3-CD2 3.9Å; W217-F219 AromaticContact CZ3-CE1 3.61Å; W217-F219 HydrophobicContact CZ3-CE1 3.61Å; W217-F219 AromaticContact CZ3-CE2 3.86Å; W217-F219 HydrophobicContact CZ3-CE2 3.86Å; W217-F219 AromaticContact CZ3-CG 3.8Å; W217-F219 HydrophobicContact CZ3-CG 3.8Å; W217-F219 AromaticContact CZ3-CZ 3.74Å; W217-F219 HydrophobicContact CZ3-CZ 3.74Å; W217-L225 HydrophobicContact CD2-CD1 4.09Å; W217-L225 HydrophobicContact CE3-CD1 3.93Å; W217-L225 HydrophobicContact CH2-CD1 3.32Å; W217-L225 HydrophobicContact CZ2-CD1 3.5Å; W217-L225 HydrophobicContact CZ3-CD1 3.54Å
218	A	87.6	Confident	89.6	Confident	51 Å²	51	57.9 Å²	57.9	42%	0.421	30%	0.299	S	S	.	.			trans	-138.3	153.1	176.1	0	0	0	0	0	110.1
219	F	85.7	Confident	89.5	Confident	26 Å²	26	59 Å²	59	11%	0.114	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-71.4	143.1	166.4	-69.8	-68.1	0	0	0	109.2	A171 D173 L178 W217 T221 S222 L225	A171-F219 HydrophobicContact CB-CE2 4.31Å; A171-F219 HydrophobicContact CB-CZ 4.36Å; D173-F219 HydrophobicContact CB-CD2 4.03Å; L178-F219 HydrophobicContact CB-CE1 3.9Å; L178-F219 HydrophobicContact CB-CZ 3.72Å; W217-F219 HydrophobicContact CH2-CD1 4.21Å; W217-F219 HydrophobicContact CH2-CD2 4.13Å; W217-F219 AromaticContact CH2-CE1 3.7Å; W217-F219 HydrophobicContact CH2-CE1 3.7Å; W217-F219 AromaticContact CH2-CE2 3.62Å; W217-F219 HydrophobicContact CH2-CE2 3.62Å; W217-F219 HydrophobicContact CH2-CG 4.41Å; W217-F219 AromaticContact CH2-CZ 3.4Å; W217-F219 HydrophobicContact CH2-CZ 3.4Å; W217-F219 VanDerWaalsContact CH2-CZ 3.4Å; W217-F219 AromaticContact CZ3-CD1 3.65Å; W217-F219 HydrophobicContact CZ3-CD1 3.65Å; W217-F219 AromaticContact CZ3-CD2 3.9Å; W217-F219 HydrophobicContact CZ3-CD2 3.9Å; W217-F219 AromaticContact CZ3-CE1 3.61Å; W217-F219 HydrophobicContact CZ3-CE1 3.61Å; W217-F219 AromaticContact CZ3-CE2 3.86Å; W217-F219 HydrophobicContact CZ3-CE2 3.86Å; W217-F219 AromaticContact CZ3-CG 3.8Å; W217-F219 HydrophobicContact CZ3-CG 3.8Å; W217-F219 AromaticContact CZ3-CZ 3.74Å; W217-F219 HydrophobicContact CZ3-CZ 3.74Å; F219-T221 WeakPolarHBondContact CB-OG1 3.39Å; F219-T221 PolarHBondContact O-N 3Å; F219-T221 VanDerWaalsContact O-N 3.12Å; F219-S222 PolarHBondContact O-N 2.78Å; F219-L225 HydrophobicContact CD2-CD1 4.03Å; F219-L225 HydrophobicContact CE2-CD1 4.01Å
220	P	85.3	Confident	89	Confident	141 Å²	141	60 Å²	60	92%	0.916	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.2	172.3	-23.7	34	0	0	0	113.2
221	T	78.3	Confident	88.7	Confident	74 Å²	74	61 Å²	61	45%	0.454	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-26	-178.6	43.2	0	0	0	0	113.9	D173 F175 S176 F219	D173-T221 WeakPolarHBondContact OD2-CB 3.31Å; D173-T221 PolarHBondContact OD2-OG1 2.97Å; F175-T221 HydrophobicContact CB-CG2 4.48Å; S176-T221 PolarHBondContact OG-OG1 2.91Å; S176-T221 VanDerWaalsContact OG-OG1 3.1Å; F219-T221 WeakPolarHBondContact CB-OG1 3.39Å; F219-T221 PolarHBondContact O-N 3Å; F219-T221 VanDerWaalsContact O-N 3.12Å
222	S	78.3	Confident	88.1	Confident	27 Å²	27	60.4 Å²	60.4	19%	0.189	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-159.7	143.4	-175.5	-174.5	0	0	0	0	112.7	D173 F219 R224	D173-S222 WeakPolarHBondContact OD2-CB 3.35Å; F219-S222 PolarHBondContact O-N 2.78Å; S222-R224 PolarHBondContact OG-N 3.28Å
223	N	79.6	Confident	87.4	Confident	147 Å²	147	63.7 Å²	63.7	79%	0.786	33%	0.33	S	S	*	.	S	Bend	trans	-82.1	0.1	168.8	67.4	-10.6	0	0	0	113.3
224	R	79.8	Confident	86.7	Confident	180 Å²	180	60.1 Å²	60.1	68%	0.679	32%	0.317	S	S	*	.			trans	-104.8	113.2	177.3	-62.6	-177.7	-176.3	178.3	0.5	110.4	D173 S222	D173-R224 WeakPolarHBondContact CB-O 3.25Å; S222-R224 PolarHBondContact OG-N 3.28Å
225	L	83.6	Confident	85.7	Confident	54 Å²	54	66.1 Å²	66.1	28%	0.283	36%	0.36	S	S	.	.			trans	-116.8	124.5	-176.3	-177.7	116.6	0	0	0	110.7	A171 W217 F219 I227	A171-L225 HydrophobicContact CB-CD1 4.12Å; A171-L225 HydrophobicContact CB-CG 4.39Å; W217-L225 HydrophobicContact CD2-CD1 4.09Å; W217-L225 HydrophobicContact CE3-CD1 3.93Å; W217-L225 HydrophobicContact CH2-CD1 3.32Å; W217-L225 HydrophobicContact CZ2-CD1 3.5Å; W217-L225 HydrophobicContact CZ3-CD1 3.54Å; F219-L225 HydrophobicContact CD2-CD1 4.03Å; F219-L225 HydrophobicContact CE2-CD1 4.01Å; L225-I227 HydrophobicContact CD2-CD1 3.7Å; L225-I227 HydrophobicContact CD2-CG1 3.54Å
226	N	87.8	Confident	85	Confident	96 Å²	96	62.3 Å²	62.3	51%	0.513	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.1	171.5	-57.9	-71.4	0	0	0	109.8	A171 S172 L228	A171-N226 CarbonylContact C-O 3.45Å; A171-N226 WeakPolarHBondContact CA-O 3.36Å; S172-N226 PolarHBondContact N-O 2.75Å; S172-N226 WeakPolarHBondContact O-CB 3.2Å; S172-N226 PolarHBondContact O-N 2.97Å; S172-N226 PolarHBondContact O-ND2 2.85Å; N226-L228 HydrophobicContact CB-CD1 4.06Å
227	I	93	Very high	84.4	Confident	34 Å²	34	69.7 Å²	69.7	17%	0.174	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.5	173.4	-61.6	168.4	0	0	0	108.1	I129 Y152 L180 W195 I214 L225	I129-I227 HydrophobicContact CD1-CD1 4.15Å; Y152-I227 HydrophobicContact CD2-CG2 4.06Å; Y152-I227 HydrophobicContact CE2-CG2 4.03Å; L180-I227 HydrophobicContact CD1-CG2 4.16Å; W195-I227 HydrophobicContact CH2-CG2 3.8Å; W195-I227 HydrophobicContact CZ3-CD1 4.24Å; W195-I227 HydrophobicContact CZ3-CG2 4.01Å; I214-I227 HydrophobicContact CD1-CD1 4.31Å; L225-I227 HydrophobicContact CD2-CD1 3.7Å; L225-I227 HydrophobicContact CD2-CG1 3.54Å
228	L	88.9	Confident	84	Confident	70 Å²	70	69.3 Å²	69.3	37%	0.366	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.2	178.8	-60.6	101.7	0	0	0	109.8	C169 W170 S172 N226	C169-L228 CarbonylContact C-O 3.6Å; C169-L228 WeakPolarHBondContact CA-O 3.49Å; W170-L228 HydrophobicContact CD2-CB 4.08Å; W170-L228 HydrophobicContact CE3-CB 4.41Å; W170-L228 HydrophobicContact CH2-CB 3.88Å; W170-L228 HydrophobicContact CZ2-CB 3.49Å; W170-L228 VanDerWaalsContact CZ2-CB 3.49Å; W170-L228 HydrophobicContact CZ2-CD1 4.48Å; W170-L228 HydrophobicContact CZ2-CD2 4.09Å; W170-L228 HydrophobicContact CZ2-CG 4.22Å; W170-L228 HydrophobicContact CZ3-CB 4.31Å; W170-L228 PolarHBondContact N-O 3.18Å; W170-L228 PolarHBondContact O-N 2.81Å; S172-L228 WeakPolarHBondContact OG-CD1 3.41Å; N226-L228 HydrophobicContact CB-CD1 4.06Å
229	C	91.3	Very high	83.6	Confident	24 Å²	24	73.1 Å²	73.1	16%	0.162	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	146	-176.5	-71.7	0	0	0	0	111.4	I166 R168 C169	I166-C229 HydrophobicContact CG2-CB 3.93Å; R168-C229 CarbonylContact O-C 3.1Å; R168-C229 WeakPolarHBondContact O-CA 3.4Å; C169-C229 HydrophobicContact CB-CB 4.17Å; C169-C229 WeakPolarHBondContact CB-SG 3.38Å; C169-C229 WeakPolarHBondContact SG-CB 3.5Å; C169-C229 CovalentContact SG-SG 2.05Å; C169-C229 PolarHBondContact SG-SG 3.06Å
230	N	87.6	Confident	83.1	Confident	20 Å²	20	76.6 Å²	76.6	11%	0.107	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.7	172	-73.6	-14	0	0	0	111	G167 R168	G167-N230 PolarHBondContact N-O 3.5Å; R168-N230 PolarHBondContact O-N 3.11Å
231	L	89	Confident	82.8	Confident	28 Å²	28	74.7 Å²	74.7	15%	0.147	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.1	170.3	-172.9	71.7	0	0	0	110.3	Y125 V156 V164 I166 L210 F233	Y125-L231 HydrophobicContact CD2-CD1 4.45Å; Y125-L231 HydrophobicContact CD2-CD2 3.67Å; Y125-L231 HydrophobicContact CE2-CD1 4.12Å; Y125-L231 HydrophobicContact CE2-CD2 4.05Å; Y125-L231 HydrophobicContact CE2-CG 4.5Å; Y125-L231 HydrophobicContact CG-CD2 4.4Å; V156-L231 HydrophobicContact CG2-CD1 4.41Å; V164-L231 HydrophobicContact CB-CD1 4.1Å; V164-L231 HydrophobicContact CG2-CD1 4.46Å; I166-L231 HydrophobicContact CG1-CD1 4.35Å; L210-L231 HydrophobicContact CD1-CD1 4.24Å; L231-F233 HydrophobicContact CD2-CE2 4.04Å; L231-F233 HydrophobicContact CD2-CZ 3.82Å; L231-F233 HydrophobicContact CG-CE2 4.35Å; L231-F233 HydrophobicContact CG-CZ 4.5Å
232	H	83.1	Confident	83	Confident	20 Å²	20	72.9 Å²	72.9	9%	0.093	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	138.1	177.6	-69.9	-95.3	0	0	0	111.1	V164 R165	V164-H232 VanDerWaalsContact CA-O 3.29Å; V164-H232 WeakPolarHBondContact CA-O 3.36Å; R165-H232 HydrophobicContact CG-CB 3.91Å; R165-H232 PolarHBondContact N-O 2.89Å; R165-H232 PolarHBondContact O-N 3.25Å
233	F	83.8	Confident	82.4	Confident	69 Å²	69	76.7 Å²	76.7	30%	0.303	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.5	170.6	-61.9	-96	0	0	0	108.6	I123 N163 V164 L231	I123-F233 HydrophobicContact CD1-CE1 4.15Å; I123-F233 HydrophobicContact CD1-CZ 3.59Å; I123-F233 HydrophobicContact CG1-CE1 4.28Å; I123-F233 HydrophobicContact CG1-CZ 4.08Å; I123-F233 HydrophobicContact CG2-CE1 4.43Å; N163-F233 WeakPolarHBondContact O-CA 3.25Å; V164-F233 HydrophobicContact CG1-CD1 3.55Å; V164-F233 HydrophobicContact CG1-CE1 3.56Å; V164-F233 HydrophobicContact CG1-CG 4.31Å; V164-F233 HydrophobicContact CG1-CZ 4.32Å; L231-F233 HydrophobicContact CD2-CE2 4.04Å; L231-F233 HydrophobicContact CD2-CZ 3.82Å; L231-F233 HydrophobicContact CG-CE2 4.35Å; L231-F233 HydrophobicContact CG-CZ 4.5Å
234	C	82.1	Confident	81	Confident	24 Å²	24	72 Å²	72	16%	0.162	41%	0.405	C	S	.	.			trans	-93.2	148.3	177.9	-57.6	0	0	0	0	109.6	N163 G236 C238	N163-C234 HydrophobicContact CB-CB 4.47Å; N163-C234 WeakPolarHBondContact CB-O 3.13Å; N163-C234 PolarHBondContact O-N 2.92Å; C234-G236 WeakPolarHBondContact CB-O 3.48Å; C234-G236 PolarHBondContact O-N 3.01Å; C234-C238 HydrophobicContact CB-CB 4.14Å; C234-C238 WeakPolarHBondContact CB-SG 3.05Å; C234-C238 WeakPolarHBondContact SG-CA 3.37Å; C234-C238 WeakPolarHBondContact SG-CB 3.42Å; C234-C238 CovalentContact SG-SG 2.04Å; C234-C238 PolarHBondContact SG-SG 3.25Å
235	S	74.2	Confident	79	Confident	135 Å²	135	69.2 Å²	69.2	94%	0.944	41%	0.411	S	S	*	.	S	Bend	trans	-66.9	-22.9	174.4	-54	0	0	0	0	112.4
236	G	79.3	Confident	76.7	Confident	34 Å²	34	73.3 Å²	73.3	35%	0.351	44%	0.438	S	S	.	.	S	Bend	trans	-143.7	-151	171.8	0	0	0	0	0	110.2	N163 C234 C238	N163-G236 WeakPolarHBondContact CB-O 3.26Å; N163-G236 VanDerWaalsContact CG-C 3.48Å; N163-G236 VanDerWaalsContact OD1-C 3.3Å; N163-G236 PolarHBondContact OD1-O 3.17Å; C234-G236 WeakPolarHBondContact CB-O 3.48Å; C234-G236 PolarHBondContact O-N 3.01Å; G236-C238 PolarHBondContact O-N 3.07Å
237	H	82.3	Confident	74	Confident	165 Å²	165	74.7 Å²	74.7	76%	0.764	45%	0.45	S	S	*	.	S	Bend	trans	-59.6	128.4	175.8	-66	-60.1	0	0	0	111.3	I239	H237-I239 PolarHBondContact O-N 2.78Å
238	C	82.6	Confident	71	Confident	37 Å²	37	77.6 Å²	77.6	25%	0.25	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-68.2	128.6	175.8	-64.2	0	0	0	0	110.1	V164 R165 C234 G236	V164-C238 VanDerWaalsContact C-SG 3.6Å; R165-C238 HydrophobicContact CB-CB 3.98Å; R165-C238 HydrophobicContact CG-CB 4.19Å; C234-C238 HydrophobicContact CB-CB 4.14Å; C234-C238 WeakPolarHBondContact CB-SG 3.05Å; C234-C238 WeakPolarHBondContact SG-CA 3.37Å; C234-C238 WeakPolarHBondContact SG-CB 3.42Å; C234-C238 CovalentContact SG-SG 2.04Å; C234-C238 PolarHBondContact SG-SG 3.25Å; G236-C238 PolarHBondContact O-N 3.07Å
239	I	79.1	Confident	68.1	Low	131 Å²	131	80.5 Å²	80.5	67%	0.672	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-81.3	136.4	175.9	-57.2	170.8	0	0	0	108.7	H237 L241	H237-I239 PolarHBondContact O-N 2.78Å; I239-L241 HydrophobicContact CG2-CD2 4Å; I239-L241 HydrophobicContact CG2-CG 4.44Å
240	N	77	Confident	65	Low	99 Å²	99	86.4 Å²	86.4	53%	0.529	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-85.3	122.4	168.5	-170	-25.2	0	0	0	109.6	E197 C242	E197-N240 VanDerWaalsContact OE1-CG 3.24Å; E197-N240 PolarHBondContact OE1-ND2 3.37Å; E197-N240 PolarHBondContact OE1-OD1 3.28Å; N240-C242 PolarHBondContact OD1-N 3.03Å
241	L	78.5	Confident	62.7	Low	101 Å²	101	91.5 Å²	91.5	53%	0.529	55%	0.553	S	S	.	*			trans	-105.8	0.4	-175.8	-65.1	170.9	0	0	0	113.3	N184 I239 S243	N184-L241 HydrophobicContact CB-CB 4.31Å; N184-L241 HydrophobicContact CB-CD1 4.3Å; N184-L241 WeakPolarHBondContact OD1-CD1 3.48Å; I239-L241 HydrophobicContact CG2-CD2 4Å; I239-L241 HydrophobicContact CG2-CG 4.44Å; L241-S243 PolarHBondContact O-N 2.93Å
242	C	81.8	Confident	59.7	Low	36 Å²	36	96.2 Å²	96.2	24%	0.243	57%	0.574	C	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-10.3	-169.6	-55.7	0	0	0	0	114.6	C186 E197 N240	C186-C242 WeakPolarHBondContact CA-SG 3.44Å; C186-C242 HydrophobicContact CB-CB 3.9Å; C186-C242 WeakPolarHBondContact CB-SG 3.4Å; C186-C242 WeakPolarHBondContact SG-CA 3.48Å; C186-C242 WeakPolarHBondContact SG-CB 3.45Å; C186-C242 CovalentContact SG-SG 2.05Å; C186-C242 PolarHBondContact SG-SG 2.77Å; E197-C242 WeakPolarHBondContact OE1-CB 3.5Å; N240-C242 PolarHBondContact OD1-N 3.03Å
243	S	65.2	Low	57	Low	107 Å²	107	103 Å²	103	75%	0.748	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	37.6	-178.8	-65.2	0	0	0	0	113.8	L241	L241-S243 PolarHBondContact O-N 2.93Å
244	G	52	Low	54.2	Low	47 Å²	47	111 Å²	111	49%	0.485	63%	0.634	S	S	.	*	S	Bend	trans	-78.5	149.2	168.4	0	0	0	0	0	111.8	T246	G244-T246 PolarHBondContact O-N 3.08Å; G244-T246 VanDerWaalsContact O-N 3.1Å
245	P	37.6	Very low	51.5	Low	123 Å²	123	117.5 Å²	117.5	80%	0.799	67%	0.666	S	S	*	*			trans	-56.8	120.2	174.7	22	-30.6	0	0	0	109.9	T247	P245-T247 PolarHBondContact O-N 2.98Å
246	T	35.5	Very low	49.1	Very low	139 Å²	139	114.6 Å²	114.6	85%	0.853	65%	0.65	S	S	*	*			trans	-68	81.8	168.3	48.9	0	0	0	0	108.4	G244 S248	G244-T246 PolarHBondContact O-N 3.08Å; G244-T246 VanDerWaalsContact O-N 3.1Å; T246-S248 PolarHBondContact O-N 3.1Å
247	T	29.7	Very low	46.5	Very low	125 Å²	125	116.3 Å²	116.3	77%	0.767	66%	0.656	S	S	*	*			trans	-66.4	95.2	153.7	50.4	0	0	0	0	106.5	P245	P245-T247 PolarHBondContact O-N 2.98Å
248	S	30.5	Very low	43.8	Very low	96 Å²	96	115.8 Å²	115.8	67%	0.671	66%	0.658	S	S	*	*			trans	-49.5	156.3	146.4	55.3	0	0	0	0	109	T246	T246-S248 PolarHBondContact O-N 3.1Å
249	T	28.7	Very low	41.2	Very low	130 Å²	130	119.9 Å²	119.9	80%	0.798	68%	0.684	S	S	*	*			trans	69.1	91.8	-172.8	37.9	0	0	0	0	116.4
250	Q	26.3	Very low	39.4	Very low	148 Å²	148	123 Å²	123	69%	0.692	71%	0.713	S	S	*	*				179.8	139.8	94.7	-90.8	-177.1	-31	0	0	110.9	H252	Q250-H252 VanDerWaalsContact CB-CD2 3.48Å; Q250-H252 WeakPolarHBondContact CB-CD2 3.28Å; Q250-H252 PolarHBondContact O-N 3.22Å; Q250-H252 PolarHBondContact OE1-CD2 3.24Å; Q250-H252 PolarHBondContact OE1-NE2 2.82Å
251	P	38.7	Very low	37.5	Very low	127 Å²	127	124.2 Å²	124.2	83%	0.825	72%	0.722	S	S	*	*			trans	-79.4	104.5	171	32.3	-26.8	0	0	0	108
252	H	26.8	Very low	35.4	Very low	127 Å²	127	125.4 Å²	125.4	59%	0.588	73%	0.732	S	S	*	*			trans	-128.3	118.5	170.7	-77.1	-67.2	0	0	0	110.7	Q250 R254	Q250-H252 VanDerWaalsContact CB-CD2 3.48Å; Q250-H252 WeakPolarHBondContact CB-CD2 3.28Å; Q250-H252 PolarHBondContact O-N 3.22Å; Q250-H252 PolarHBondContact OE1-CD2 3.24Å; Q250-H252 PolarHBondContact OE1-NE2 2.82Å; H252-R254 PolarHBondContact O-N 2.88Å
253	H	26.3	Very low	32.8	Very low	164 Å²	164	130.4 Å²	130.4	76%	0.759	76%	0.759	S	S	*	*			trans	-30.7	105.4	150.7	-79.9	-61.8	0	0	0	110.1	I255	H253-I255 VanDerWaalsContact C-N 3.3Å; H253-I255 PolarHBondContact O-N 2.69Å
254	R	24	Very low	30.9	Very low	235 Å²	235	131.8 Å²	131.8	89%	0.887	76%	0.76	S	S	*	*			trans	-88.9	78.8	168.1	-73.6	-164.3	-177.7	-136.1	2.7	109.1	H252	H252-R254 PolarHBondContact O-N 2.88Å
255	I	26.3	Very low	29.5	Very low	161 Å²	161	137.1 Å²	137.1	83%	0.826	78%	0.777	S	S	*	*			trans	-81.5	109.3	137.7	-64	172.4	0	0	0	104.2	H253	H253-I255 VanDerWaalsContact C-N 3.3Å; H253-I255 PolarHBondContact O-N 2.69Å
256	A	24	Very low	29	Very low	74 Å²	74	138 Å²	138	61%	0.612	78%	0.775	S	S	*	*			trans	-155.2	83.4	175.8	0	0	0	0	0	111.1
257	C	24.3	Very low	28.6	Very low	70 Å²	70	137.9 Å²	137.9	47%	0.473	77%	0.77	S	S	.	*				-141.4	131	109.8	-73.6	0	0	0	0	103.4	K11	K11-C257 PolarHBondContact NZ-SG 2.74Å
258	L	25.3	Very low	28.5	Very low	155 Å²	155	138.9 Å²	138.9	81%	0.812	77%	0.77	S	S	*	*				-165.6	154	83.2	-80.1	151.8	0	0	0	109.4
259	P	28.6	Very low	28.3	Very low	122 Å²	122	142.5 Å²	142.5	79%	0.792	78%	0.778	S	S	*	*				-142.2	168	121.5	39.2	-27.4	0	0	0	114.4
260	P	40.3	Very low	28.3	Very low	197 Å²	197	143.6 Å²	143.6	100%	1.279	78%	0.777	S	S	*	*			cis	-99.3	0	-13.3	35.5	-24.8	0	0	0	112.8

Retrieved 260 of 260 residues in 109.6 ms (Link to these results)

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