A0A2K5P333_CERAT Loading...

Kelch repeat and BTB domain-containing protein 8

Substrate-specific adapter of a BCR (BTB-CUL3-RBX1) E3 ubiquitin ligase complex that acts as a regulator of neural crest specification. The BCR(KBTBD8) complex acts by mediating monoubiquitination of NOLC1 and TCOF1: monoubiquitination promotes the formation of a NOLC1-TCOF1 complex that acts as a platform to connect RNA polymerase I with enzymes responsible for ribosomal processing and modification, leading to remodel the translational program of differentiating cells in favor of neural crest specification.

AlphaFold DB , UniProt , Accession A0A2K5P333, Species CERAT (Cercocebus atys, Sooty mangabey), Gene KBTBD8, Length 601 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	31.2	Very low	242 Å²	242	138.3 Å²	138.3	100%	1.192	86%	0.856	S	S	*	*				0	89.1	0	-64.7	-170.5	-149.6	0	0	106.4
2	A	31.2	Very low	31.8	Very low	104 Å²	104	136.9 Å²	136.9	86%	0.86	85%	0.851	S	S	*	*				75.3	103.2	84.2	0	0	0	0	0	112
3	A	30.2	Very low	32.2	Very low	108 Å²	108	136.2 Å²	136.2	89%	0.893	85%	0.846	S	S	*	*			trans	-166.1	104.1	133.8	0	0	0	0	0	109.3
4	S	29.7	Very low	33.7	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	83%	0.834	S	S	*	*			trans	-84.2	153.9	168.3	46.9	0	0	0	0	111.3
5	A	31.1	Very low	34	Very low	97 Å²	97	135.8 Å²	135.8	80%	0.802	84%	0.836	S	S	*	*			trans	-161.3	95.9	144.6	0	0	0	0	0	107.6
6	D	30.4	Very low	34.1	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	83%	0.828	S	S	*	*				74.4	103.1	91.3	-95.1	-19.2	0	0	0	114
7	L	29.7	Very low	35	Very low	178 Å²	178	133.8 Å²	133.8	93%	0.932	83%	0.83	S	S	*	*			trans	-139.6	94.5	147.4	-96.2	166.8	0	0	0	107.8
8	S	31.5	Very low	35.5	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	82%	0.822	S	S	*	*			trans	-71.9	132.4	163.5	51.5	0	0	0	0	109.4
9	K	32.8	Very low	36.3	Very low	208 Å²	208	131.2 Å²	131.2	90%	0.904	82%	0.82	S	S	*	*			trans	-156.7	123.5	145.7	-108.8	167.4	-168.6	-176.7	0	110.6
10	S	31.7	Very low	37	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	82%	0.816	S	S	*	*			trans	-63	143.2	-178.8	48.8	0	0	0	0	114.4
11	S	30.4	Very low	37.9	Very low	107 Å²	107	130.7 Å²	130.7	75%	0.748	81%	0.814	S	S	*	*			trans	-77.1	153.9	152.5	54.5	0	0	0	0	111
12	P	38	Very low	38.9	Very low	122 Å²	122	125 Å²	125	79%	0.792	80%	0.796	S	S	*	*				-139.6	149.3	99.8	31	-13.7	0	0	0	115
13	T	36.8	Very low	40.3	Very low	128 Å²	128	124.6 Å²	124.6	79%	0.785	79%	0.792	S	S	*	*			trans	-63.8	175.4	171.1	50.2	0	0	0	0	113
14	P	53	Low	42	Very low	104 Å²	104	124.7 Å²	124.7	68%	0.675	79%	0.786	S	S	*	*			cis	-146.6	179.5	19.3	38.8	-16.1	0	0	0	117.7
15	N	39.2	Very low	43.6	Very low	162 Å²	162	126.5 Å²	126.5	87%	0.866	79%	0.787	S	S	*	*			trans	84.6	99	158.2	-64.2	-15	0	0	0	118.7
16	G	35.9	Very low	45.7	Very low	68 Å²	68	126.3 Å²	126.3	70%	0.701	79%	0.786	S	S	*	*			trans	171.4	93.7	159	0	0	0	0	0	108.3	P18	G16-P18 WeakPolarHBondContact O-CD 3.33Å
17	I	49.4	Very low	47.9	Very low	170 Å²	170	127 Å²	127	87%	0.872	79%	0.786	S	S	*	*			trans	-63.8	125.5	167.2	-63.7	164.2	0	0	0	106.6
18	P	43.3	Very low	50.5	Low	106 Å²	106	123.1 Å²	123.1	69%	0.688	77%	0.766	S	S	*	*				-121	126.3	121.6	30.6	-21.8	0	0	0	108.3	G16 S20	G16-P18 WeakPolarHBondContact O-CD 3.33Å; P18-S20 PolarHBondContact O-N 3.48Å
19	S	51.5	Low	53	Low	111 Å²	111	123.5 Å²	123.5	78%	0.776	77%	0.766	S	S	*	*			trans	-47.9	106.1	163.1	49.1	0	0	0	0	109.3
20	S	50.1	Low	55.7	Low	106 Å²	106	121 Å²	121	74%	0.741	76%	0.755	S	S	*	*			trans	-111.5	105.4	161	41.6	0	0	0	0	105.7	P18	P18-S20 PolarHBondContact O-N 3.48Å
21	D	55.7	Low	58.4	Low	146 Å²	146	120.8 Å²	120.8	78%	0.781	74%	0.742	S	S	*	*			trans	-49.2	137.4	162.5	-76.3	-43.9	0	0	0	108.1	A23	D21-A23 PolarHBondContact O-N 3.11Å
22	P	54.6	Low	61.1	Low	124 Å²	124	119.2 Å²	119.2	81%	0.805	74%	0.735	S	S	*	*			trans	-68	92.8	168.4	28.3	-29.5	0	0	0	106.4	S24	P22-S24 PolarHBondContact O-N 3.35Å
23	A	61.6	Low	63.4	Low	95 Å²	95	116.6 Å²	116.6	79%	0.785	72%	0.719	S	S	*	*			trans	-56	109.4	175.8	0	0	0	0	0	108	D21 D25	D21-A23 PolarHBondContact O-N 3.11Å; A23-D25 PolarHBondContact O-N 2.94Å; A23-D25 VanDerWaalsContact O-N 3.15Å
24	S	64.9	Low	65.9	Low	109 Å²	109	113.2 Å²	113.2	76%	0.762	70%	0.701	S	S	*	*			trans	-73.3	103.3	171.5	61.3	0	0	0	0	107.3	P22 A26	P22-S24 PolarHBondContact O-N 3.35Å; S24-A26 VanDerWaalsContact C-N 3.29Å; S24-A26 PolarHBondContact O-N 2.73Å
25	D	64.5	Low	67.8	Low	152 Å²	152	111.8 Å²	111.8	81%	0.813	69%	0.687	S	S	*	*			trans	-73.8	85.1	176.2	-159.1	8.8	0	0	0	109.1	A23 M27	A23-D25 PolarHBondContact O-N 2.94Å; A23-D25 VanDerWaalsContact O-N 3.15Å; D25-M27 PolarHBondContact O-N 3.1Å
26	A	73.8	Confident	70.3	Confident	94 Å²	94	106.3 Å²	106.3	78%	0.777	66%	0.657	S	S	*	*			trans	-87.4	98.4	179.3	0	0	0	0	0	109.8	S24	S24-A26 VanDerWaalsContact C-N 3.29Å; S24-A26 PolarHBondContact O-N 2.73Å
27	M	77.9	Confident	72.9	Confident	162 Å²	162	109.8 Å²	109.8	80%	0.798	65%	0.653	S	S	*	*			trans	-92.2	122.4	174.4	-79.2	-97.3	-77.7	0	0	110.6	D25 P29	D25-M27 PolarHBondContact O-N 3.1Å; M27-P29 VanDerWaalsContact O-CD 3.27Å; M27-P29 WeakPolarHBondContact O-CD 3.28Å
28	D	83.8	Confident	74.9	Confident	98 Å²	98	106.8 Å²	106.8	52%	0.524	64%	0.635	S	S	.	*			trans	-81.4	109.3	167.8	174.1	11	0	0	0	109.7	F30 H31	D28-F30 PolarHBondContact O-N 3.05Å; D28-F30 PolarHBondContact OD1-N 3.36Å; D28-H31 HydrophobicContact CB-CB 4.14Å; D28-H31 PolarHBondContact O-N 2.82Å
29	P	84.2	Confident	77.2	Confident	109 Å²	109	103.6 Å²	103.6	71%	0.708	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-15.7	-177.1	28.3	-34.1	0	0	0	113.5	M27	M27-P29 VanDerWaalsContact O-CD 3.27Å; M27-P29 WeakPolarHBondContact O-CD 3.28Å
30	F	88.9	Confident	79.2	Confident	154 Å²	154	100.1 Å²	100.1	68%	0.675	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-8	-178.1	-61.7	-72.6	0	0	0	113.8	D28 A32 C33 S34	D28-F30 PolarHBondContact O-N 3.05Å; D28-F30 PolarHBondContact OD1-N 3.36Å; F30-A32 PolarHBondContact O-N 2.88Å; F30-C33 PolarHBondContact O-N 3.39Å; F30-C33 VanDerWaalsContact O-N 3.15Å; F30-S34 PolarHBondContact O-N 3.15Å
31	H	89.1	Confident	81.2	Confident	109 Å²	109	98.5 Å²	98.5	51%	0.505	57%	0.569	S	S	.	*	H	α-helix	trans	-55.5	-48.4	-174.6	-173.6	63.2	0	0	0	112.7	D28 C33 S34 I35	D28-H31 HydrophobicContact CB-CB 4.14Å; D28-H31 PolarHBondContact O-N 2.82Å; H31-C33 PolarHBondContact O-N 2.82Å; H31-S34 WeakPolarHBondContact O-CB 3.42Å; H31-S34 PolarHBondContact O-N 2.89Å; H31-I35 VanDerWaalsContact NE2-CD1 3.29Å; H31-I35 WeakPolarHBondContact NE2-CD1 3.49Å; H31-I35 WeakPolarHBondContact O-CG1 3.19Å; H31-I35 PolarHBondContact O-N 3.27Å
32	A	86.3	Confident	83	Confident	74 Å²	74	94 Å²	94	61%	0.612	54%	0.544	S	S	*	.	H	α-helix	trans	-61.6	-40.7	179.3	0	0	0	0	0	112.8	F30 I35 L36	F30-A32 PolarHBondContact O-N 2.88Å; A32-I35 PolarHBondContact O-N 2.94Å; A32-L36 WeakPolarHBondContact O-CB 3.46Å; A32-L36 PolarHBondContact O-N 2.85Å
33	C	87.9	Confident	84.8	Confident	67 Å²	67	89.6 Å²	89.6	45%	0.453	51%	0.512	S	S	.	.	H	α-helix	trans	-69.3	-35.6	178.1	-167.4	0	0	0	0	111.6	F30 H31 K37	F30-C33 PolarHBondContact O-N 3.39Å; F30-C33 VanDerWaalsContact O-N 3.15Å; H31-C33 PolarHBondContact O-N 2.82Å; C33-K37 WeakPolarHBondContact O-CB 3.46Å; C33-K37 VanDerWaalsContact O-CG 3.29Å; C33-K37 WeakPolarHBondContact O-CG 3.35Å; C33-K37 PolarHBondContact O-N 2.91Å
34	S	89.4	Confident	86.2	Confident	57 Å²	57	89.9 Å²	89.9	40%	0.399	50%	0.5	S	S	.	.	H	α-helix	trans	-65.5	-44.5	174.8	-171.5	0	0	0	0	112	F30 H31 K37 Q38	F30-S34 PolarHBondContact O-N 3.15Å; H31-S34 WeakPolarHBondContact O-CB 3.42Å; H31-S34 PolarHBondContact O-N 2.89Å; S34-K37 PolarHBondContact O-N 2.83Å; S34-Q38 WeakPolarHBondContact O-CG 3.48Å; S34-Q38 PolarHBondContact O-N 3.15Å; S34-Q38 VanDerWaalsContact O-N 3.07Å
35	I	91.6	Very high	87.5	Confident	75 Å²	75	90.2 Å²	90.2	39%	0.385	49%	0.489	S	S	.	.	H	α-helix	trans	-60.5	-48.8	175.4	-71.4	173.9	0	0	0	110.6	H31 A32 K37 Q38 L39	H31-I35 VanDerWaalsContact NE2-CD1 3.29Å; H31-I35 WeakPolarHBondContact NE2-CD1 3.49Å; H31-I35 WeakPolarHBondContact O-CG1 3.19Å; H31-I35 PolarHBondContact O-N 3.27Å; A32-I35 PolarHBondContact O-N 2.94Å; I35-K37 VanDerWaalsContact C-N 3.29Å; I35-K37 PolarHBondContact O-N 2.63Å; I35-Q38 PolarHBondContact O-N 3.22Å; I35-Q38 VanDerWaalsContact O-N 3.09Å; I35-L39 HydrophobicContact CG2-CD1 3.9Å; I35-L39 HydrophobicContact CG2-CG 4.29Å; I35-L39 WeakPolarHBondContact O-CG 3.39Å; I35-L39 PolarHBondContact O-N 3.18Å
36	L	91.2	Very high	88.7	Confident	46 Å²	46	85 Å²	85	24%	0.241	47%	0.471	C	S	.	.	H	α-helix	trans	-62.6	-38	-177.5	-165.5	69.9	0	0	0	111.8	A32 L39 K40 Y109	A32-L36 WeakPolarHBondContact O-CB 3.46Å; A32-L36 PolarHBondContact O-N 2.85Å; L36-L39 PolarHBondContact O-N 3.06Å; L36-K40 PolarHBondContact O-N 3.39Å; L36-Y109 VanDerWaalsContact CG-O 3.32Å; L36-Y109 WeakPolarHBondContact CG-O 3.46Å
37	K	91.4	Very high	89.5	Confident	142 Å²	142	85.1 Å²	85.1	62%	0.617	46%	0.456	S	S	*	.	H	α-helix	trans	-60.9	-43.9	172.3	-76.7	173.7	-177.6	177.8	0	112.3	C33 S34 I35 K40 T41	C33-K37 WeakPolarHBondContact O-CB 3.46Å; C33-K37 VanDerWaalsContact O-CG 3.29Å; C33-K37 WeakPolarHBondContact O-CG 3.35Å; C33-K37 PolarHBondContact O-N 2.91Å; S34-K37 PolarHBondContact O-N 2.83Å; I35-K37 VanDerWaalsContact C-N 3.29Å; I35-K37 PolarHBondContact O-N 2.63Å; K37-K40 WeakPolarHBondContact O-CB 3.48Å; K37-K40 PolarHBondContact O-N 3.43Å; K37-T41 PolarHBondContact O-N 2.61Å; K37-T41 PolarHBondContact O-OG1 3.11Å
38	Q	91.8	Very high	90.1	Very high	106 Å²	106	83.9 Å²	83.9	50%	0.495	45%	0.452	S	S	.	.	H	α-helix	trans	-65.6	-40.5	177.2	-70.8	177.9	50	0	0	111.8	S34 I35 K40 T41 M42	S34-Q38 WeakPolarHBondContact O-CG 3.48Å; S34-Q38 PolarHBondContact O-N 3.15Å; S34-Q38 VanDerWaalsContact O-N 3.07Å; I35-Q38 PolarHBondContact O-N 3.22Å; I35-Q38 VanDerWaalsContact O-N 3.09Å; Q38-K40 VanDerWaalsContact C-N 3.3Å; Q38-K40 PolarHBondContact O-N 2.83Å; Q38-T41 WeakPolarHBondContact O-CB 3.38Å; Q38-T41 PolarHBondContact O-N 3.25Å; Q38-M42 WeakPolarHBondContact O-CG 3.35Å; Q38-M42 PolarHBondContact O-N 3.26Å
39	L	92.1	Very high	90.4	Very high	39 Å²	39	81.3 Å²	81.3	20%	0.204	44%	0.439	C	S	.	.	H	α-helix	trans	-62.6	-36.8	174.3	-69.9	173	0	0	0	112.1	I35 L36 M42 Y43 V67 Y109	I35-L39 HydrophobicContact CG2-CD1 3.9Å; I35-L39 HydrophobicContact CG2-CG 4.29Å; I35-L39 WeakPolarHBondContact O-CG 3.39Å; I35-L39 PolarHBondContact O-N 3.18Å; L36-L39 PolarHBondContact O-N 3.06Å; L39-M42 HydrophobicContact CD2-SD 4.41Å; L39-M42 PolarHBondContact O-N 2.73Å; L39-Y43 WeakPolarHBondContact O-CB 3.45Å; L39-Y43 PolarHBondContact O-N 3.4Å; L39-V67 HydrophobicContact CD1-CG2 4.15Å; L39-Y109 HydrophobicContact CB-CD1 4.21Å; L39-Y109 HydrophobicContact CB-CE1 4.44Å
40	K	92.3	Very high	90.7	Very high	38 Å²	38	79.7 Å²	79.7	17%	0.165	43%	0.425	C	S	.	.	H	α-helix	trans	-62.8	-45.2	172.4	-177.2	67	173.2	72	0	111.5	L36 K37 Q38 M42 Y43 D44 Y109 T110	L36-K40 PolarHBondContact O-N 3.39Å; K37-K40 WeakPolarHBondContact O-CB 3.48Å; K37-K40 PolarHBondContact O-N 3.43Å; Q38-K40 VanDerWaalsContact C-N 3.3Å; Q38-K40 PolarHBondContact O-N 2.83Å; K40-M42 VanDerWaalsContact C-N 3.34Å; K40-M42 PolarHBondContact O-N 2.57Å; K40-Y43 HydrophobicContact CD-CD1 4.4Å; K40-Y43 WeakPolarHBondContact O-CB 3.42Å; K40-Y43 PolarHBondContact O-N 3Å; K40-D44 IonicContact NZ-OD1 3.55Å; K40-D44 PolarHBondContact NZ-OD1 2.94Å; K40-D44 IonicContact NZ-OD2 2.68Å; K40-D44 PolarHBondContact NZ-OD2 3.42Å; K40-D44 PolarHBondContact O-N 3.49Å; K40-Y109 VanDerWaalsContact CD-CB 3.44Å; K40-Y109 HydrophobicContact CD-CG 4.23Å; K40-T110 HydrophobicContact CD-CG2 3.85Å; K40-T110 HydrophobicContact CG-CG2 4.28Å
41	T	93.4	Very high	90.8	Very high	72 Å²	72	72.5 Å²	72.5	44%	0.442	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-44.4	176.1	-53.5	0	0	0	0	111.4	K37 Q38 Y43 D44 E45	K37-T41 PolarHBondContact O-N 2.61Å; K37-T41 PolarHBondContact O-OG1 3.11Å; Q38-T41 WeakPolarHBondContact O-CB 3.38Å; Q38-T41 PolarHBondContact O-N 3.25Å; T41-Y43 VanDerWaalsContact C-N 3.31Å; T41-Y43 PolarHBondContact O-N 2.95Å; T41-D44 PolarHBondContact O-N 3.25Å; T41-E45 WeakPolarHBondContact O-CG 3.22Å; T41-E45 PolarHBondContact O-N 3.04Å
42	M	92.8	Very high	91	Very high	53 Å²	53	69.2 Å²	69.2	26%	0.261	38%	0.381	S	S	.	.	H	α-helix	trans	-62.3	-39	176.7	-68.1	173.6	-170.9	0	0	112	Q38 L39 K40 E45 G46 Q47 L48	Q38-M42 WeakPolarHBondContact O-CG 3.35Å; Q38-M42 PolarHBondContact O-N 3.26Å; L39-M42 HydrophobicContact CD2-SD 4.41Å; L39-M42 PolarHBondContact O-N 2.73Å; K40-M42 VanDerWaalsContact C-N 3.34Å; K40-M42 PolarHBondContact O-N 2.57Å; M42-E45 PolarHBondContact O-N 3.04Å; M42-G46 PolarHBondContact O-N 3.43Å; M42-Q47 HydrophobicContact CB-CB 4.44Å; M42-Q47 PolarHBondContact O-N 3.47Å; M42-L48 HydrophobicContact SD-CD1 4.16Å
43	Y	92.7	Very high	91.2	Very high	31 Å²	31	65.7 Å²	65.7	12%	0.122	35%	0.352	C	S	.	.	H	α-helix	trans	-63.1	-45.7	174.4	172.4	-101.2	0	0	0	112	L39 K40 T41 E45 G46 S62 C63 Y109	L39-Y43 WeakPolarHBondContact O-CB 3.45Å; L39-Y43 PolarHBondContact O-N 3.4Å; K40-Y43 HydrophobicContact CD-CD1 4.4Å; K40-Y43 WeakPolarHBondContact O-CB 3.42Å; K40-Y43 PolarHBondContact O-N 3Å; T41-Y43 VanDerWaalsContact C-N 3.31Å; T41-Y43 PolarHBondContact O-N 2.95Å; Y43-E45 VanDerWaalsContact C-N 3.3Å; Y43-E45 PolarHBondContact O-N 2.94Å; Y43-G46 PolarHBondContact O-N 2.95Å; Y43-G46 VanDerWaalsContact O-N 3.1Å; Y43-S62 WeakPolarHBondContact CD2-O 3.46Å; Y43-S62 WeakPolarHBondContact CE2-O 3.41Å; Y43-C63 HydrophobicContact CD2-CB 4.43Å; Y43-C63 HydrophobicContact CE2-CB 4.1Å; Y43-Y109 HydrophobicContact CD1-CD2 4.1Å; Y43-Y109 HydrophobicContact CD1-CE2 4.15Å; Y43-Y109 HydrophobicContact CD2-CD2 4.23Å; Y43-Y109 HydrophobicContact CD2-CE1 4.47Å; Y43-Y109 AromaticContact CD2-CE2 3.46Å; Y43-Y109 HydrophobicContact CD2-CE2 3.46Å; Y43-Y109 VanDerWaalsContact CD2-CE2 3.46Å; Y43-Y109 AromaticContact CD2-CZ 3.61Å; Y43-Y109 HydrophobicContact CE1-CD2 4.45Å; Y43-Y109 HydrophobicContact CE1-CE2 4.46Å; Y43-Y109 AromaticContact CE2-CE2 3.82Å; Y43-Y109 HydrophobicContact CE2-CE2 3.82Å; Y43-Y109 AromaticContact CG-CD2 3.98Å; Y43-Y109 HydrophobicContact CG-CD2 3.98Å; Y43-Y109 HydrophobicContact CG-CE1 4.3Å; Y43-Y109 AromaticContact CG-CE2 3.64Å; Y43-Y109 HydrophobicContact CG-CE2 3.64Å; Y43-Y109 HydrophobicContact CG-CG 4.48Å; Y43-Y109 AromaticContact CG-CZ 3.81Å
44	D	90.9	Very high	91.4	Very high	100 Å²	100	64.9 Å²	64.9	54%	0.535	34%	0.342	S	S	.	.	H	α-helix	trans	-66.1	-32.5	179.6	-68.8	-24.3	0	0	0	112.8	K40 T41 G46	K40-D44 IonicContact NZ-OD1 3.55Å; K40-D44 PolarHBondContact NZ-OD1 2.94Å; K40-D44 IonicContact NZ-OD2 2.68Å; K40-D44 PolarHBondContact NZ-OD2 3.42Å; K40-D44 PolarHBondContact O-N 3.49Å; T41-D44 PolarHBondContact O-N 3.25Å; D44-G46 VanDerWaalsContact C-N 3.33Å
45	E	92.2	Very high	91.5	Very high	117 Å²	117	62.2 Å²	62.2	55%	0.547	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-4.7	175.5	-66.6	178.7	-174.5	0	0	113.2	T41 M42 Y43 Q47	T41-E45 WeakPolarHBondContact O-CG 3.22Å; T41-E45 PolarHBondContact O-N 3.04Å; M42-E45 PolarHBondContact O-N 3.04Å; Y43-E45 VanDerWaalsContact C-N 3.3Å; Y43-E45 PolarHBondContact O-N 2.94Å; E45-Q47 HydrophobicContact CB-CG 4Å; E45-Q47 PolarHBondContact O-N 3.22Å; E45-Q47 VanDerWaalsContact OE2-CD 3.29Å; E45-Q47 PolarHBondContact OE2-NE2 3.23Å
46	G	89.3	Confident	91.2	Very high	42 Å²	42	60.4 Å²	60.4	43%	0.433	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	25.4	-176.8	0	0	0	0	0	114	M42 Y43 D44	M42-G46 PolarHBondContact O-N 3.43Å; Y43-G46 PolarHBondContact O-N 2.95Å; Y43-G46 VanDerWaalsContact O-N 3.1Å; D44-G46 VanDerWaalsContact C-N 3.33Å
47	Q	90.9	Very high	90.7	Very high	96 Å²	96	67.3 Å²	67.3	45%	0.449	34%	0.344	S	S	.	.			trans	-87.1	141.1	180	-67.7	177.7	8.6	0	0	110.6	M42 E45 T49 H64	M42-Q47 HydrophobicContact CB-CB 4.44Å; M42-Q47 PolarHBondContact O-N 3.47Å; E45-Q47 HydrophobicContact CB-CG 4Å; E45-Q47 PolarHBondContact O-N 3.22Å; E45-Q47 VanDerWaalsContact OE2-CD 3.29Å; E45-Q47 PolarHBondContact OE2-NE2 3.23Å; Q47-T49 PolarHBondContact O-N 2.85Å; Q47-H64 PolarHBondContact O-NE2 3.18Å
48	L	89.9	Confident	90.1	Very high	137 Å²	137	62.6 Å²	62.6	72%	0.717	34%	0.336	S	S	*	.	S	Bend	trans	59.2	14	175.4	-54.6	175.4	0	0	0	115.6	M42 D50 H64	M42-L48 HydrophobicContact SD-CD1 4.16Å; L48-D50 PolarHBondContact O-N 2.91Å; L48-H64 PolarHBondContact O-CD2 3.2Å; L48-H64 VanDerWaalsContact O-CD2 3.23Å
49	T	90	Very high	90.1	Very high	43 Å²	43	62.4 Å²	62.4	26%	0.264	33%	0.334	S	S	.	.			trans	-68.6	124.5	174.6	59.4	0	0	0	0	110.6	Q47 C63	Q47-T49 PolarHBondContact O-N 2.85Å; T49-C63 WeakPolarHBondContact CA-O 3.45Å
50	D	91.4	Very high	90.1	Very high	75 Å²	75	64.1 Å²	64.1	40%	0.401	35%	0.346	S	S	.	.			trans	-116.5	5.3	-171.2	61.4	-10.8	0	0	0	113.3	L48 C63 H64 R65	L48-D50 PolarHBondContact O-N 2.91Å; D50-C63 PolarHBondContact N-O 3.15Å; D50-C63 VanDerWaalsContact N-O 3.15Å; D50-H64 VanDerWaalsContact OD1-CA 3.24Å; D50-H64 WeakPolarHBondContact OD1-CA 3.39Å; D50-R65 PolarHBondContact O-NE 3.39Å; D50-R65 VanDerWaalsContact O-NE 3.15Å; D50-R65 WeakPolarHBondContact OD1-CG 3.49Å; D50-R65 PolarHBondContact OD1-N 3.12Å; D50-R65 WeakPolarHBondContact OD2-CB 3.44Å
51	I	91.1	Very high	90.1	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.015	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.6	172.9	-174.3	168.3	0	0	0	111.6	V53 S62 C63 R65 L68 F79 K89 V91	I51-V53 HydrophobicContact CD1-CG2 4.47Å; I51-V53 HydrophobicContact CG1-CG2 4.43Å; I51-S62 WeakPolarHBondContact O-CA 3.43Å; I51-C63 WeakPolarHBondContact CG2-O 3.21Å; I51-C63 PolarHBondContact N-O 3.27Å; I51-C63 PolarHBondContact O-N 3.03Å; I51-R65 HydrophobicContact CB-CG 3.83Å; I51-R65 HydrophobicContact CD1-CG 4.43Å; I51-R65 HydrophobicContact CG2-CG 3.71Å; I51-L68 HydrophobicContact CG2-CD1 4.45Å; I51-F79 HydrophobicContact CD1-CD1 4.34Å; I51-F79 HydrophobicContact CD1-CE1 3.27Å; I51-F79 HydrophobicContact CD1-CZ 3.4Å; I51-F79 VanDerWaalsContact CD1-CZ 3.4Å; I51-K89 CarbonylContact C-O 3.14Å; I51-K89 WeakPolarHBondContact CA-O 3.25Å; I51-V91 HydrophobicContact CD1-CB 4.45Å; I51-V91 HydrophobicContact CD1-CG2 3.91Å
52	V	92.3	Very high	90.1	Very high	40 Å²	40	62.1 Å²	62.1	24%	0.242	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.6	169.2	-178.1	0	0	0	0	108.6	T60 F61 K89 E90 V91	V52-T60 HydrophobicContact CG1-CG2 4.19Å; V52-F61 CarbonylContact C-O 3.57Å; V52-F61 WeakPolarHBondContact CA-O 3.48Å; V52-K89 PolarHBondContact N-O 3.33Å; V52-E90 HydrophobicContact CB-CG 4.41Å; V52-E90 HydrophobicContact CG1-CG 4.49Å; V52-E90 CarbonylContact O-C 3.59Å; V52-E90 VanDerWaalsContact O-CA 3.28Å; V52-E90 WeakPolarHBondContact O-CA 3.32Å; V52-V91 PolarHBondContact O-N 3.49Å
53	V	90.9	Very high	90.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.2	176.1	179.2	0	0	0	0	109.1	I51 V55 T60 F61 L68 V91 I93 M101	I51-V53 HydrophobicContact CD1-CG2 4.47Å; I51-V53 HydrophobicContact CG1-CG2 4.43Å; V53-V55 HydrophobicContact CG1-CG1 4.3Å; V53-T60 CarbonylContact O-C 3.56Å; V53-T60 WeakPolarHBondContact O-CA 3.24Å; V53-F61 PolarHBondContact N-O 3.28Å; V53-F61 PolarHBondContact O-N 3.1Å; V53-L68 HydrophobicContact CG2-CD1 4.26Å; V53-V91 CarbonylContact C-O 3.59Å; V53-V91 WeakPolarHBondContact CA-O 3.31Å; V53-I93 HydrophobicContact CG1-CD1 3.44Å; V53-I93 VanDerWaalsContact CG1-CD1 3.44Å; V53-I93 HydrophobicContact CG1-CG1 3.92Å; V53-M101 HydrophobicContact CB-CE 4.26Å; V53-M101 HydrophobicContact CG1-CE 3.85Å; V53-M101 HydrophobicContact CG2-CE 4.4Å
54	E	91.6	Very high	90.2	Very high	51 Å²	51	58.5 Å²	58.5	24%	0.238	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.4	171.3	-170.8	-168.5	175	0	0	109.3	K59 T60 V91 R92 I93	E54-K59 WeakPolarHBondContact CA-O 3.12Å; E54-T60 HydrophobicContact CB-CG2 4.2Å; E54-T60 HydrophobicContact CG-CG2 4.15Å; E54-V91 PolarHBondContact N-O 2.72Å; E54-R92 HydrophobicContact CB-CB 4.4Å; E54-R92 HydrophobicContact CB-CG 4.48Å; E54-R92 CarbonylContact O-C 3.55Å; E54-R92 WeakPolarHBondContact O-CA 3.42Å; E54-I93 PolarHBondContact O-N 3.42Å
55	V	91.2	Very high	90.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.304	C	S	.	.			trans	-110.3	178.8	175	-61.5	0	0	0	0	111.2	V53 G58 K59 F61 A98 M101	V53-V55 HydrophobicContact CG1-CG1 4.3Å; V55-G58 PolarHBondContact O-N 3.24Å; V55-G58 VanDerWaalsContact O-N 3.11Å; V55-K59 HydrophobicContact CG2-CB 3.98Å; V55-K59 WeakPolarHBondContact CG2-O 3.34Å; V55-K59 PolarHBondContact N-O 3.27Å; V55-F61 HydrophobicContact CG1-CD2 4.44Å; V55-F61 HydrophobicContact CG1-CE2 4.31Å; V55-F61 HydrophobicContact CG2-CD2 4.47Å; V55-F61 HydrophobicContact CG2-CE2 3.84Å; V55-A98 HydrophobicContact CG2-CB 4.11Å; V55-M101 HydrophobicContact CG1-CB 3.88Å; V55-M101 HydrophobicContact CG1-CG 3.76Å; V55-M101 HydrophobicContact CG1-SD 4.44Å
56	D	84.9	Confident	90.1	Very high	37 Å²	37	54.8 Å²	54.8	20%	0.198	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-56.3	147.7	178.9	-69.4	-34	0	0	0	112.1	G58 G95 V96	D56-G58 PolarHBondContact O-N 3.25Å; D56-G95 VanDerWaalsContact OD2-CA 3.22Å; D56-G95 WeakPolarHBondContact OD2-CA 3.37Å; D56-G95 PolarHBondContact OD2-N 2.99Å; D56-V96 PolarHBondContact N-O 3.32Å; D56-V96 PolarHBondContact OD2-N 3.38Å; D56-V96 VanDerWaalsContact OD2-N 3.17Å
57	H	80.8	Confident	90.3	Very high	191 Å²	191	53.4 Å²	53.4	88%	0.884	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	65.7	15.5	-171.2	-46.7	-72.3	0	0	0	115.3	K59	H57-K59 PolarHBondContact O-N 3.46Å
58	G	80.3	Confident	90.3	Very high	44 Å²	44	48.8 Å²	48.8	45%	0.454	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	78	18	166	0	0	0	0	0	114.8	V55 D56	V55-G58 PolarHBondContact O-N 3.24Å; V55-G58 VanDerWaalsContact O-N 3.11Å; D56-G58 PolarHBondContact O-N 3.25Å
59	K	90.4	Very high	90.4	Very high	101 Å²	101	43.3 Å²	43.3	44%	0.439	24%	0.239	S	C	.	.			trans	-79.1	135.7	173.1	-165.1	-177.5	-175.7	-178.3	0	109.6	E54 V55 H57 F61 A98	E54-K59 WeakPolarHBondContact CA-O 3.12Å; V55-K59 HydrophobicContact CG2-CB 3.98Å; V55-K59 WeakPolarHBondContact CG2-O 3.34Å; V55-K59 PolarHBondContact N-O 3.27Å; H57-K59 PolarHBondContact O-N 3.46Å; K59-F61 HydrophobicContact CD-CE2 4.1Å; K59-F61 HydrophobicContact CD-CZ 3.78Å; K59-F61 HydrophobicContact CG-CE2 4.24Å; K59-F61 HydrophobicContact CG-CZ 4.32Å; K59-A98 HydrophobicContact CB-CB 4.2Å; K59-A98 HydrophobicContact CD-CB 3.46Å; K59-A98 VanDerWaalsContact CD-CB 3.46Å; K59-A98 HydrophobicContact CG-CB 4.46Å
60	T	92.6	Very high	90.5	Very high	75 Å²	75	45.5 Å²	45.5	46%	0.46	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.5	-177	57.5	0	0	0	0	112.1	V52 V53 E54	V52-T60 HydrophobicContact CG1-CG2 4.19Å; V53-T60 CarbonylContact O-C 3.56Å; V53-T60 WeakPolarHBondContact O-CA 3.24Å; E54-T60 HydrophobicContact CB-CG2 4.2Å; E54-T60 HydrophobicContact CG-CG2 4.15Å
61	F	93	Very high	90.5	Very high	13 Å²	13	44 Å²	44	6%	0.057	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.4	177.4	-62.2	-91	0	0	0	110.8	V52 V53 V55 K59 A98 M101 D102 L105	V52-F61 CarbonylContact C-O 3.57Å; V52-F61 WeakPolarHBondContact CA-O 3.48Å; V53-F61 PolarHBondContact N-O 3.28Å; V53-F61 PolarHBondContact O-N 3.1Å; V55-F61 HydrophobicContact CG1-CD2 4.44Å; V55-F61 HydrophobicContact CG1-CE2 4.31Å; V55-F61 HydrophobicContact CG2-CD2 4.47Å; V55-F61 HydrophobicContact CG2-CE2 3.84Å; K59-F61 HydrophobicContact CD-CE2 4.1Å; K59-F61 HydrophobicContact CD-CZ 3.78Å; K59-F61 HydrophobicContact CG-CE2 4.24Å; K59-F61 HydrophobicContact CG-CZ 4.32Å; F61-A98 WeakPolarHBondContact CZ-O 3.32Å; F61-M101 HydrophobicContact CD2-CG 3.94Å; F61-M101 HydrophobicContact CE2-CB 4Å; F61-M101 HydrophobicContact CE2-CG 3.89Å; F61-M101 HydrophobicContact CZ-CB 4.35Å; F61-M101 HydrophobicContact CZ-CG 4.47Å; F61-D102 HydrophobicContact CE1-CB 4.13Å; F61-D102 HydrophobicContact CZ-CB 4.31Å; F61-L105 HydrophobicContact CB-CD1 3.69Å; F61-L105 HydrophobicContact CD1-CD1 3.6Å; F61-L105 HydrophobicContact CD2-CD1 4.45Å; F61-L105 HydrophobicContact CE1-CD1 4.3Å; F61-L105 HydrophobicContact CG-CD1 3.68Å
62	S	92.7	Very high	90.6	Very high	56 Å²	56	43.9 Å²	43.9	39%	0.392	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	118.9	173.9	-59.8	0	0	0	0	109.9	Y43 I51	Y43-S62 WeakPolarHBondContact CD2-O 3.46Å; Y43-S62 WeakPolarHBondContact CE2-O 3.41Å; I51-S62 WeakPolarHBondContact O-CA 3.43Å
63	C	93.9	Very high	90.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	178.6	-173.6	50	0	0	0	0	112.5	Y43 T49 D50 I51 L68 L105	Y43-C63 HydrophobicContact CD2-CB 4.43Å; Y43-C63 HydrophobicContact CE2-CB 4.1Å; T49-C63 WeakPolarHBondContact CA-O 3.45Å; D50-C63 PolarHBondContact N-O 3.15Å; D50-C63 VanDerWaalsContact N-O 3.15Å; I51-C63 WeakPolarHBondContact CG2-O 3.21Å; I51-C63 PolarHBondContact N-O 3.27Å; I51-C63 PolarHBondContact O-N 3.03Å; C63-L68 HydrophobicContact CB-CD1 4.45Å; C63-L68 WeakPolarHBondContact SG-CD1 3.24Å; C63-L105 HydrophobicContact CB-CD2 4.16Å
64	H	93.8	Very high	90.7	Very high	8 Å²	8	48 Å²	48	4%	0.037	27%	0.271	C	S	.	.			trans	-101.2	126.2	179.9	-50.2	93.3	0	0	0	111.3	Q47 L48 D50 N66 V67 L68 Y109	Q47-H64 PolarHBondContact O-NE2 3.18Å; L48-H64 PolarHBondContact O-CD2 3.2Å; L48-H64 VanDerWaalsContact O-CD2 3.23Å; D50-H64 VanDerWaalsContact OD1-CA 3.24Å; D50-H64 WeakPolarHBondContact OD1-CA 3.39Å; H64-N66 VanDerWaalsContact C-N 3.28Å; H64-N66 WeakPolarHBondContact CB-OD1 3.23Å; H64-N66 PolarHBondContact O-N 3.17Å; H64-V67 HydrophobicContact CB-CB 4.32Å; H64-V67 HydrophobicContact CB-CG2 4.09Å; H64-V67 PolarHBondContact O-N 3.42Å; H64-L68 PolarHBondContact O-N 3.29Å; H64-L68 VanDerWaalsContact O-N 3.15Å; H64-Y109 PolarHBondContact N-OH 3.27Å; H64-Y109 AromaticContact ND1-CE1 3.56Å; H64-Y109 AromaticContact ND1-CZ 3.59Å; H64-Y109 PolarHBondContact ND1-OH 3.14Å
65	R	91.1	Very high	90.7	Very high	39 Å²	39	45.6 Å²	45.6	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-58.2	-40.1	178.7	-72.1	174.7	-176.9	-96.6	-6.6	112.2	D50 I51 L68 A69 F79 S86 Q88	D50-R65 PolarHBondContact O-NE 3.39Å; D50-R65 VanDerWaalsContact O-NE 3.15Å; D50-R65 WeakPolarHBondContact OD1-CG 3.49Å; D50-R65 PolarHBondContact OD1-N 3.12Å; D50-R65 WeakPolarHBondContact OD2-CB 3.44Å; I51-R65 HydrophobicContact CB-CG 3.83Å; I51-R65 HydrophobicContact CD1-CG 4.43Å; I51-R65 HydrophobicContact CG2-CG 3.71Å; R65-L68 PolarHBondContact O-N 3.2Å; R65-A69 WeakPolarHBondContact O-CB 3.47Å; R65-A69 PolarHBondContact O-N 2.89Å; R65-F79 HydrophobicContact CB-CD2 3.85Å; R65-F79 HydrophobicContact CB-CE2 3.95Å; R65-F79 HydrophobicContact CG-CD2 4.11Å; R65-F79 HydrophobicContact CG-CE2 4.06Å; R65-F79 HydrophobicContact CG-CG 4.43Å; R65-F79 HydrophobicContact CG-CZ 4.32Å; R65-S86 PolarHBondContact NH1-O 2.94Å; R65-Q88 PolarHBondContact NH2-O 3.41Å
66	N	90.8	Very high	90.7	Very high	99 Å²	99	52.7 Å²	52.7	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-41.2	-178.8	64.3	-17.6	0	0	0	112	H64 A70	H64-N66 VanDerWaalsContact C-N 3.28Å; H64-N66 WeakPolarHBondContact CB-OD1 3.23Å; H64-N66 PolarHBondContact O-N 3.17Å; N66-A70 VanDerWaalsContact O-CB 3.25Å; N66-A70 WeakPolarHBondContact O-CB 3.44Å; N66-A70 PolarHBondContact O-N 3.29Å
67	V	92.6	Very high	90.9	Very high	13 Å²	13	54 Å²	54	8%	0.079	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-46.4	177.9	176	0	0	0	0	110.2	L39 H64 A69 A70 I71 A108 Y109	L39-V67 HydrophobicContact CD1-CG2 4.15Å; H64-V67 HydrophobicContact CB-CB 4.32Å; H64-V67 HydrophobicContact CB-CG2 4.09Å; H64-V67 PolarHBondContact O-N 3.42Å; V67-A69 PolarHBondContact O-N 3.17Å; V67-A70 PolarHBondContact O-N 2.72Å; V67-I71 PolarHBondContact O-N 3.05Å; V67-A108 HydrophobicContact CG1-CB 3.99Å; V67-Y109 HydrophobicContact CB-CE1 4.07Å; V67-Y109 HydrophobicContact CG1-CD1 4.1Å; V67-Y109 HydrophobicContact CG1-CE1 3.79Å; V67-Y109 HydrophobicContact CG1-CE2 4.4Å; V67-Y109 HydrophobicContact CG2-CD1 4.46Å; V67-Y109 HydrophobicContact CG2-CE1 3.79Å
68	L	91.8	Very high	91.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-42.8	176.7	-73.6	-174.7	0	0	0	112.7	I51 V53 C63 H64 R65 A70 I71 S72 F75 F79 L105	I51-L68 HydrophobicContact CG2-CD1 4.45Å; V53-L68 HydrophobicContact CG2-CD1 4.26Å; C63-L68 HydrophobicContact CB-CD1 4.45Å; C63-L68 WeakPolarHBondContact SG-CD1 3.24Å; H64-L68 PolarHBondContact O-N 3.29Å; H64-L68 VanDerWaalsContact O-N 3.15Å; R65-L68 PolarHBondContact O-N 3.2Å; L68-A70 VanDerWaalsContact C-N 3.31Å; L68-A70 PolarHBondContact O-N 3.29Å; L68-I71 WeakPolarHBondContact O-CG2 3.47Å; L68-I71 PolarHBondContact O-N 2.92Å; L68-S72 WeakPolarHBondContact O-CB 3.46Å; L68-S72 PolarHBondContact O-N 3.44Å; L68-F75 HydrophobicContact CB-CB 4.02Å; L68-F75 HydrophobicContact CB-CD2 4.02Å; L68-F75 HydrophobicContact CB-CG 4Å; L68-F75 HydrophobicContact CD1-CD1 4.41Å; L68-F75 HydrophobicContact CD1-CD2 4.47Å; L68-F75 HydrophobicContact CD1-CE1 4.46Å; L68-F75 HydrophobicContact CD1-CG 4.44Å; L68-F75 HydrophobicContact CD2-CD2 4.11Å; L68-F75 HydrophobicContact CD2-CE2 4.12Å; L68-F75 HydrophobicContact CG-CD2 4.44Å; L68-F79 HydrophobicContact CB-CE2 3.98Å; L68-F79 HydrophobicContact CD1-CZ 4.36Å; L68-L105 HydrophobicContact CD2-CD2 3.78Å
69	A	92	Very high	91.7	Very high	22 Å²	22	45.4 Å²	45.4	18%	0.182	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-29.1	176.4	0	0	0	0	0	113.2	R65 V67 R76 F79	R65-A69 WeakPolarHBondContact O-CB 3.47Å; R65-A69 PolarHBondContact O-N 2.89Å; V67-A69 PolarHBondContact O-N 3.17Å; A69-R76 HydrophobicContact CB-CB 4.13Å; A69-R76 HydrophobicContact CB-CG 4.27Å; A69-R76 WeakPolarHBondContact O-CB 3.4Å; A69-F79 HydrophobicContact CB-CD2 4.12Å
70	A	91.4	Very high	91.5	Very high	89 Å²	89	45.6 Å²	45.6	74%	0.736	26%	0.257	S	S	*	.	H	α-helix	trans	-70.7	-36.9	176.8	0	0	0	0	0	111.7	N66 V67 L68	N66-A70 VanDerWaalsContact O-CB 3.25Å; N66-A70 WeakPolarHBondContact O-CB 3.44Å; N66-A70 PolarHBondContact O-N 3.29Å; V67-A70 PolarHBondContact O-N 2.72Å; L68-A70 VanDerWaalsContact C-N 3.31Å; L68-A70 PolarHBondContact O-N 3.29Å
71	I	91.6	Very high	90.9	Very high	42 Å²	42	44.8 Å²	44.8	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-90.2	-26	-175.1	-161.2	156.1	0	0	0	114.5	V67 L68 Y107 A108 I132	V67-I71 PolarHBondContact O-N 3.05Å; L68-I71 WeakPolarHBondContact O-CG2 3.47Å; L68-I71 PolarHBondContact O-N 2.92Å; I71-Y107 HydrophobicContact CD1-CD1 3.45Å; I71-Y107 VanDerWaalsContact CD1-CD1 3.45Å; I71-Y107 HydrophobicContact CD1-CE1 3.52Å; I71-Y107 HydrophobicContact CG1-CD1 4.44Å; I71-Y107 HydrophobicContact CG1-CE1 4.21Å; I71-A108 VanDerWaalsContact CD1-CA 3.44Å; I71-A108 HydrophobicContact CD1-CB 3.79Å; I71-A108 HydrophobicContact CG2-CB 4.18Å; I71-I132 HydrophobicContact CG1-CD1 4.47Å; I71-I132 HydrophobicContact CG1-CG2 4.34Å; I71-I132 HydrophobicContact CG2-CD1 4.48Å
72	S	93.9	Very high	89.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.007	28%	0.283	C	S	.	.			trans	-130.9	120.5	-171.2	167.4	0	0	0	0	111.5	L68 Y74 F75 R76 F130	L68-S72 WeakPolarHBondContact O-CB 3.46Å; L68-S72 PolarHBondContact O-N 3.44Å; S72-Y74 PolarHBondContact O-N 2.9Å; S72-Y74 WeakPolarHBondContact OG-CB 3.2Å; S72-Y74 PolarHBondContact OG-N 2.81Å; S72-F75 PolarHBondContact O-N 3.34Å; S72-F75 WeakPolarHBondContact OG-CD2 3.31Å; S72-F75 PolarHBondContact OG-N 2.87Å; S72-R76 WeakPolarHBondContact O-CB 3.39Å; S72-R76 PolarHBondContact O-N 3.07Å; S72-F130 WeakPolarHBondContact CB-O 3.42Å; S72-F130 PolarHBondContact OG-O 3.44Å
73	P	92.9	Very high	89.1	Confident	53 Å²	53	49.8 Å²	49.8	34%	0.344	29%	0.292	S	S	.	.	H	α-helix	trans	-59.1	-30.8	170.2	-22.3	33.6	0	0	0	113.3	S77 Q131	P73-S77 WeakPolarHBondContact O-CB 3.48Å; P73-S77 PolarHBondContact O-N 2.99Å; P73-S77 PolarHBondContact O-OG 2.92Å; P73-Q131 WeakPolarHBondContact CD-O 3.3Å; P73-Q131 HydrophobicContact CG-CB 4.43Å
74	Y	91.9	Very high	88	Confident	74 Å²	74	54 Å²	54	29%	0.29	32%	0.318	S	S	.	.	H	α-helix	trans	-62	-54.3	175.2	171.7	-95.8	0	0	0	110.8	S72 R76 S77 M78 F130	S72-Y74 PolarHBondContact O-N 2.9Å; S72-Y74 WeakPolarHBondContact OG-CB 3.2Å; S72-Y74 PolarHBondContact OG-N 2.81Å; Y74-R76 VanDerWaalsContact C-N 3.34Å; Y74-R76 PolarHBondContact O-N 3.37Å; Y74-S77 PolarHBondContact O-N 3.33Å; Y74-M78 HydrophobicContact CD1-CE 4.3Å; Y74-M78 HydrophobicContact CE1-CE 3.36Å; Y74-M78 HydrophobicContact CE2-CE 4.41Å; Y74-M78 VanDerWaalsContact CZ-CE 3.43Å; Y74-M78 WeakPolarHBondContact O-CB 3.45Å; Y74-M78 PolarHBondContact O-N 2.89Å; Y74-M78 VanDerWaalsContact OH-CE 3.23Å; Y74-M78 WeakPolarHBondContact OH-CE 3.25Å; Y74-F130 AromaticContact CD1-CD1 3.92Å; Y74-F130 HydrophobicContact CD1-CD1 3.92Å; Y74-F130 HydrophobicContact CE1-CD1 4.15Å; Y74-F130 HydrophobicContact CE1-CE1 4.39Å
75	F	91.2	Very high	87.1	Confident	1 Å²	1	57 Å²	57	0%	0.004	33%	0.332	C	S	.	.	H	α-helix	trans	-65.4	-37.6	177.3	-72.8	-57.1	0	0	0	112.2	L68 S72 S77 M78 F79 I93 M101 F130	L68-F75 HydrophobicContact CB-CB 4.02Å; L68-F75 HydrophobicContact CB-CD2 4.02Å; L68-F75 HydrophobicContact CB-CG 4Å; L68-F75 HydrophobicContact CD1-CD1 4.41Å; L68-F75 HydrophobicContact CD1-CD2 4.47Å; L68-F75 HydrophobicContact CD1-CE1 4.46Å; L68-F75 HydrophobicContact CD1-CG 4.44Å; L68-F75 HydrophobicContact CD2-CD2 4.11Å; L68-F75 HydrophobicContact CD2-CE2 4.12Å; L68-F75 HydrophobicContact CG-CD2 4.44Å; S72-F75 PolarHBondContact O-N 3.34Å; S72-F75 WeakPolarHBondContact OG-CD2 3.31Å; S72-F75 PolarHBondContact OG-N 2.87Å; F75-S77 PolarHBondContact O-N 3.33Å; F75-M78 HydrophobicContact CD1-SD 4.29Å; F75-M78 PolarHBondContact O-N 3.45Å; F75-F79 HydrophobicContact CB-CD2 4.45Å; F75-F79 HydrophobicContact CB-CE2 3.84Å; F75-F79 HydrophobicContact CB-CZ 4.14Å; F75-F79 HydrophobicContact CD1-CE2 4.38Å; F75-F79 AromaticContact CD1-CZ 3.84Å; F75-F79 HydrophobicContact CD1-CZ 3.84Å; F75-F79 HydrophobicContact CG-CE2 4.43Å; F75-F79 HydrophobicContact CG-CZ 4.33Å; F75-F79 WeakPolarHBondContact O-CD2 3.49Å; F75-F79 VanDerWaalsContact O-CG 3.24Å; F75-F79 WeakPolarHBondContact O-CG 3.35Å; F75-F79 PolarHBondContact O-N 3.02Å; F75-I93 HydrophobicContact CE1-CD1 3.66Å; F75-I93 HydrophobicContact CZ-CD1 3.65Å; F75-M101 HydrophobicContact CZ-CE 4.32Å; F75-F130 HydrophobicContact CE2-CB 4.46Å; F75-F130 AromaticContact CE2-CD1 3.77Å; F75-F130 HydrophobicContact CE2-CD1 3.77Å; F75-F130 HydrophobicContact CE2-CD2 4.45Å; F75-F130 HydrophobicContact CE2-CE1 4.1Å; F75-F130 AromaticContact CE2-CG 3.98Å; F75-F130 HydrophobicContact CE2-CG 3.98Å; F75-F130 AromaticContact CZ-CD1 3.76Å; F75-F130 HydrophobicContact CZ-CD1 3.76Å; F75-F130 AromaticContact CZ-CE1 3.66Å; F75-F130 HydrophobicContact CZ-CE1 3.66Å; F75-F130 HydrophobicContact CZ-CG 4.38Å; F75-F130 HydrophobicContact CZ-CZ 4.16Å
76	R	90.6	Very high	86.4	Confident	148 Å²	148	56.5 Å²	56.5	56%	0.558	33%	0.334	S	S	*	.	H	α-helix	trans	-56.9	-51.5	174.5	-165.7	174.7	80.4	-175.6	4.6	110.9	A69 S72 Y74 M78 F79 T80	A69-R76 HydrophobicContact CB-CB 4.13Å; A69-R76 HydrophobicContact CB-CG 4.27Å; A69-R76 WeakPolarHBondContact O-CB 3.4Å; S72-R76 WeakPolarHBondContact O-CB 3.39Å; S72-R76 PolarHBondContact O-N 3.07Å; Y74-R76 VanDerWaalsContact C-N 3.34Å; Y74-R76 PolarHBondContact O-N 3.37Å; R76-M78 VanDerWaalsContact C-N 3.34Å; R76-M78 PolarHBondContact O-N 3.36Å; R76-F79 PolarHBondContact O-N 3.46Å; R76-T80 HydrophobicContact CG-CG2 4.49Å; R76-T80 WeakPolarHBondContact O-CB 3.47Å; R76-T80 WeakPolarHBondContact O-CG2 3.42Å; R76-T80 PolarHBondContact O-N 3.25Å; R76-T80 PolarHBondContact O-OG1 2.94Å
77	S	90.3	Very high	85.8	Confident	66 Å²	66	57.2 Å²	57.2	46%	0.462	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-41.5	180	-55.6	0	0	0	0	111.4	P73 Y74 F75 F79 T80 S81	P73-S77 WeakPolarHBondContact O-CB 3.48Å; P73-S77 PolarHBondContact O-N 2.99Å; P73-S77 PolarHBondContact O-OG 2.92Å; Y74-S77 PolarHBondContact O-N 3.33Å; F75-S77 PolarHBondContact O-N 3.33Å; S77-F79 PolarHBondContact O-N 3.17Å; S77-T80 PolarHBondContact O-N 3.5Å; S77-S81 WeakPolarHBondContact O-CA 3.42Å; S77-S81 WeakPolarHBondContact O-CB 3.47Å; S77-S81 PolarHBondContact O-N 2.82Å; S77-S81 PolarHBondContact O-OG 3.18Å; S77-S81 VanDerWaalsContact O-OG 3.12Å
78	M	88.2	Confident	85.3	Confident	25 Å²	25	60.9 Å²	60.9	12%	0.123	36%	0.359	C	S	.	.	H	α-helix	trans	-57.1	-46.9	175.5	-176.3	-173.4	-73.2	0	0	111.7	Y74 F75 R76 S81 E85 V91	Y74-M78 HydrophobicContact CD1-CE 4.3Å; Y74-M78 HydrophobicContact CE1-CE 3.36Å; Y74-M78 HydrophobicContact CE2-CE 4.41Å; Y74-M78 VanDerWaalsContact CZ-CE 3.43Å; Y74-M78 WeakPolarHBondContact O-CB 3.45Å; Y74-M78 PolarHBondContact O-N 2.89Å; Y74-M78 VanDerWaalsContact OH-CE 3.23Å; Y74-M78 WeakPolarHBondContact OH-CE 3.25Å; F75-M78 HydrophobicContact CD1-SD 4.29Å; F75-M78 PolarHBondContact O-N 3.45Å; R76-M78 VanDerWaalsContact C-N 3.34Å; R76-M78 PolarHBondContact O-N 3.36Å; M78-S81 PolarHBondContact O-OG 3.36Å; M78-E85 HydrophobicContact CG-CB 3.86Å; M78-V91 HydrophobicContact CE-CG1 4.11Å; M78-V91 HydrophobicContact SD-CG1 3.78Å; M78-V91 HydrophobicContact SD-CG2 4.32Å
79	F	88.4	Confident	85	Confident	28 Å²	28	69.1 Å²	69.1	12%	0.123	39%	0.394	C	S	.	.	H	α-helix	trans	-80.2	-21.9	-176.9	-54	-28.9	0	0	0	113.9	I51 R65 L68 A69 F75 R76 S77 S86	I51-F79 HydrophobicContact CD1-CD1 4.34Å; I51-F79 HydrophobicContact CD1-CE1 3.27Å; I51-F79 HydrophobicContact CD1-CZ 3.4Å; I51-F79 VanDerWaalsContact CD1-CZ 3.4Å; R65-F79 HydrophobicContact CB-CD2 3.85Å; R65-F79 HydrophobicContact CB-CE2 3.95Å; R65-F79 HydrophobicContact CG-CD2 4.11Å; R65-F79 HydrophobicContact CG-CE2 4.06Å; R65-F79 HydrophobicContact CG-CG 4.43Å; R65-F79 HydrophobicContact CG-CZ 4.32Å; L68-F79 HydrophobicContact CB-CE2 3.98Å; L68-F79 HydrophobicContact CD1-CZ 4.36Å; A69-F79 HydrophobicContact CB-CD2 4.12Å; F75-F79 HydrophobicContact CB-CD2 4.45Å; F75-F79 HydrophobicContact CB-CE2 3.84Å; F75-F79 HydrophobicContact CB-CZ 4.14Å; F75-F79 HydrophobicContact CD1-CE2 4.38Å; F75-F79 AromaticContact CD1-CZ 3.84Å; F75-F79 HydrophobicContact CD1-CZ 3.84Å; F75-F79 HydrophobicContact CG-CE2 4.43Å; F75-F79 HydrophobicContact CG-CZ 4.33Å; F75-F79 WeakPolarHBondContact O-CD2 3.49Å; F75-F79 VanDerWaalsContact O-CG 3.24Å; F75-F79 WeakPolarHBondContact O-CG 3.35Å; F75-F79 PolarHBondContact O-N 3.02Å; R76-F79 PolarHBondContact O-N 3.46Å; S77-F79 PolarHBondContact O-N 3.17Å; F79-S86 WeakPolarHBondContact O-CB 3.17Å
80	T	87.1	Confident	84.8	Confident	106 Å²	106	73.1 Å²	73.1	65%	0.65	41%	0.409	S	S	*	.	H	α-helix	trans	-103.9	-6.8	-179.2	65.8	0	0	0	0	114.7	R76 S77 G82	R76-T80 HydrophobicContact CG-CG2 4.49Å; R76-T80 WeakPolarHBondContact O-CB 3.47Å; R76-T80 WeakPolarHBondContact O-CG2 3.42Å; R76-T80 PolarHBondContact O-N 3.25Å; R76-T80 PolarHBondContact O-OG1 2.94Å; S77-T80 PolarHBondContact O-N 3.5Å; T80-G82 VanDerWaalsContact C-N 3.26Å; T80-G82 PolarHBondContact O-N 3.39Å
81	S	80.6	Confident	84.7	Confident	57 Å²	57	69.3 Å²	69.3	40%	0.399	38%	0.377	S	S	.	.	S	Bend	trans	-71.4	-12.6	-174.6	56.8	0	0	0	0	115.1	S77 M78 L83	S77-S81 WeakPolarHBondContact O-CA 3.42Å; S77-S81 WeakPolarHBondContact O-CB 3.47Å; S77-S81 PolarHBondContact O-N 2.82Å; S77-S81 PolarHBondContact O-OG 3.18Å; S77-S81 VanDerWaalsContact O-OG 3.12Å; M78-S81 PolarHBondContact O-OG 3.36Å; S81-L83 PolarHBondContact O-N 3.01Å
82	G	72.2	Confident	84.6	Confident	65 Å²	65	75 Å²	75	67%	0.67	40%	0.396	S	S	*	.			trans	70.3	7.9	-176	0	0	0	0	0	114.4	T80	T80-G82 VanDerWaalsContact C-N 3.26Å; T80-G82 PolarHBondContact O-N 3.39Å
83	L	76	Confident	84.3	Confident	110 Å²	110	75.2 Å²	75.2	58%	0.576	40%	0.396	S	S	*	.	S	Bend	trans	-77.4	173	171.9	-64.5	172.8	0	0	0	111.1	S81 E85 S86	S81-L83 PolarHBondContact O-N 3.01Å; L83-E85 WeakPolarHBondContact CB-OE2 3.5Å; L83-E85 PolarHBondContact O-N 3.04Å; L83-E85 VanDerWaalsContact O-N 3.11Å; L83-S86 WeakPolarHBondContact O-CB 3.46Å; L83-S86 PolarHBondContact O-N 3.4Å; L83-S86 PolarHBondContact O-OG 3.31Å
84	T	70.8	Confident	84	Confident	88 Å²	88	77.5 Å²	77.5	54%	0.54	41%	0.409	S	S	.	.	H	α-helix	trans	-50.2	-39.6	-176.6	32.1	0	0	0	0	113.4	S86 T87 Q88	T84-S86 PolarHBondContact O-N 3.46Å; T84-T87 PolarHBondContact O-N 3.46Å; T84-T87 PolarHBondContact O-OG1 2.89Å; T84-Q88 WeakPolarHBondContact O-CG 3.37Å; T84-Q88 PolarHBondContact O-N 3.39Å
85	E	74.3	Confident	83.7	Confident	71 Å²	71	76.1 Å²	76.1	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-63.7	-25.2	-178.8	-64.2	84	165	0	0	112.7	M78 L83 T87	M78-E85 HydrophobicContact CG-CB 3.86Å; L83-E85 WeakPolarHBondContact CB-OE2 3.5Å; L83-E85 PolarHBondContact O-N 3.04Å; L83-E85 VanDerWaalsContact O-N 3.11Å; E85-T87 VanDerWaalsContact C-N 3.25Å; E85-T87 PolarHBondContact O-N 2.94Å
86	S	76.1	Confident	83.6	Confident	28 Å²	28	76.1 Å²	76.1	20%	0.196	42%	0.418	C	S	.	.	H	α-helix	trans	-69.5	-24.7	175.6	69.1	0	0	0	0	112.8	R65 F79 L83 T84	R65-S86 PolarHBondContact NH1-O 2.94Å; F79-S86 WeakPolarHBondContact O-CB 3.17Å; L83-S86 WeakPolarHBondContact O-CB 3.46Å; L83-S86 PolarHBondContact O-N 3.4Å; L83-S86 PolarHBondContact O-OG 3.31Å; T84-S86 PolarHBondContact O-N 3.46Å
87	T	77.7	Confident	83.7	Confident	114 Å²	114	74.2 Å²	74.2	70%	0.699	42%	0.415	S	S	*	.	H	α-helix	trans	-106.8	-17.5	-177.3	60.7	0	0	0	0	114.3	T84 E85	T84-T87 PolarHBondContact O-N 3.46Å; T84-T87 PolarHBondContact O-OG1 2.89Å; E85-T87 VanDerWaalsContact C-N 3.25Å; E85-T87 PolarHBondContact O-N 2.94Å
88	Q	83.3	Confident	83.7	Confident	91 Å²	91	72.1 Å²	72.1	43%	0.425	40%	0.402	S	S	.	.			trans	-75.4	133.9	-179.6	-76.5	176	-5.8	0	0	111.8	R65 T84 E90	R65-Q88 PolarHBondContact NH2-O 3.41Å; T84-Q88 WeakPolarHBondContact O-CG 3.37Å; T84-Q88 PolarHBondContact O-N 3.39Å; Q88-E90 VanDerWaalsContact C-N 3.3Å
89	K	84.1	Confident	83.9	Confident	173 Å²	173	77.8 Å²	77.8	75%	0.752	43%	0.428	S	S	*	.	S	Bend	trans	-73.7	-19.8	176.4	-73	-171.3	176.5	-174.4	0	113.7	I51 V52	I51-K89 CarbonylContact C-O 3.14Å; I51-K89 WeakPolarHBondContact CA-O 3.25Å; V52-K89 PolarHBondContact N-O 3.33Å
90	E	88.9	Confident	84.2	Confident	105 Å²	105	76.5 Å²	76.5	49%	0.491	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.6	-177.5	-174.7	169.5	-156	0	0	109.4	V52 Q88	V52-E90 HydrophobicContact CB-CG 4.41Å; V52-E90 HydrophobicContact CG1-CG 4.49Å; V52-E90 CarbonylContact O-C 3.59Å; V52-E90 VanDerWaalsContact O-CA 3.28Å; V52-E90 WeakPolarHBondContact O-CA 3.32Å; Q88-E90 VanDerWaalsContact C-N 3.3Å
91	V	89.1	Confident	84.5	Confident	9 Å²	9	71.5 Å²	71.5	6%	0.055	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.1	-179.6	177.1	0	0	0	0	109.1	I51 V52 V53 E54 M78 I93	I51-V91 HydrophobicContact CD1-CB 4.45Å; I51-V91 HydrophobicContact CD1-CG2 3.91Å; V52-V91 PolarHBondContact O-N 3.49Å; V53-V91 CarbonylContact C-O 3.59Å; V53-V91 WeakPolarHBondContact CA-O 3.31Å; E54-V91 PolarHBondContact N-O 2.72Å; M78-V91 HydrophobicContact CE-CG1 4.11Å; M78-V91 HydrophobicContact SD-CG1 3.78Å; M78-V91 HydrophobicContact SD-CG2 4.32Å; V91-I93 HydrophobicContact CG1-CG1 4.47Å
92	R	88.9	Confident	85.1	Confident	163 Å²	163	71.4 Å²	71.4	62%	0.615	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	126	176.7	-176.6	174.9	169.6	-170.6	-1.7	111.3	E54	E54-R92 HydrophobicContact CB-CB 4.4Å; E54-R92 HydrophobicContact CB-CG 4.48Å; E54-R92 CarbonylContact O-C 3.55Å; E54-R92 WeakPolarHBondContact O-CA 3.42Å
93	I	88.3	Confident	86.1	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.021	36%	0.362	C	S	.	.			trans	-111	123.9	177.5	-54.6	-179.3	0	0	0	108.2	V53 E54 F75 V91 V96 F130	V53-I93 HydrophobicContact CG1-CD1 3.44Å; V53-I93 VanDerWaalsContact CG1-CD1 3.44Å; V53-I93 HydrophobicContact CG1-CG1 3.92Å; E54-I93 PolarHBondContact O-N 3.42Å; F75-I93 HydrophobicContact CE1-CD1 3.66Å; F75-I93 HydrophobicContact CZ-CD1 3.65Å; V91-I93 HydrophobicContact CG1-CG1 4.47Å; I93-V96 HydrophobicContact CG2-CB 4.36Å; I93-V96 HydrophobicContact CG2-CG2 3.9Å; I93-F130 HydrophobicContact CD1-CE1 3.74Å; I93-F130 HydrophobicContact CD1-CZ 4.04Å; I93-F130 HydrophobicContact CG2-CE1 3.92Å; I93-F130 HydrophobicContact CG2-CZ 4.19Å
94	V	86.9	Confident	87	Confident	102 Å²	102	64.4 Å²	64.4	62%	0.618	33%	0.334	S	S	*	.	S	Bend	trans	-101.7	142.6	-179.3	-175.3	0	0	0	0	109.5
95	G	84.3	Confident	88	Confident	44 Å²	44	60.2 Å²	60.2	45%	0.454	31%	0.309	S	S	.	.	S	Bend	trans	87	19	177.8	0	0	0	0	0	114.2	D56	D56-G95 VanDerWaalsContact OD2-CA 3.22Å; D56-G95 WeakPolarHBondContact OD2-CA 3.37Å; D56-G95 PolarHBondContact OD2-N 2.99Å
96	V	90.7	Very high	88.9	Confident	2 Å²	2	59 Å²	59	1%	0.012	31%	0.305	C	S	.	.			trans	-131.2	124	179.5	-178.8	0	0	0	0	109.8	D56 I93 M101 A126 I129 F130	D56-V96 PolarHBondContact N-O 3.32Å; D56-V96 PolarHBondContact OD2-N 3.38Å; D56-V96 VanDerWaalsContact OD2-N 3.17Å; I93-V96 HydrophobicContact CG2-CB 4.36Å; I93-V96 HydrophobicContact CG2-CG2 3.9Å; V96-M101 HydrophobicContact CG1-CB 4.24Å; V96-A126 HydrophobicContact CG1-CB 3.95Å; V96-A126 HydrophobicContact CG2-CB 4.46Å; V96-I129 HydrophobicContact CG2-CD1 3.8Å; V96-F130 HydrophobicContact CB-CZ 4.47Å; V96-F130 HydrophobicContact CG1-CE2 4.26Å; V96-F130 HydrophobicContact CG1-CZ 4.13Å; V96-F130 HydrophobicContact CG2-CE1 4.44Å; V96-F130 HydrophobicContact CG2-CE2 4.49Å; V96-F130 HydrophobicContact CG2-CZ 3.91Å
97	E	91.1	Very high	89.7	Confident	108 Å²	108	59.2 Å²	59.2	51%	0.505	30%	0.301	S	S	.	.			trans	-72.9	149.3	176.2	-63.6	178.5	176.7	0	0	112.1	E99 S100 M101	E97-E99 VanDerWaalsContact C-N 3.28Å; E97-E99 PolarHBondContact O-N 2.84Å; E97-S100 PolarHBondContact O-N 3.33Å; E97-M101 PolarHBondContact O-N 2.87Å
98	A	91.9	Very high	90.4	Very high	22 Å²	22	54.1 Å²	54.1	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-55.4	-37.8	177.7	0	0	0	0	0	114.6	V55 K59 F61 D102	V55-A98 HydrophobicContact CG2-CB 4.11Å; K59-A98 HydrophobicContact CB-CB 4.2Å; K59-A98 HydrophobicContact CD-CB 3.46Å; K59-A98 VanDerWaalsContact CD-CB 3.46Å; K59-A98 HydrophobicContact CG-CB 4.46Å; F61-A98 WeakPolarHBondContact CZ-O 3.32Å; A98-D102 PolarHBondContact O-N 3.27Å; A98-D102 VanDerWaalsContact O-N 3.1Å
99	E	92.3	Very high	90.9	Very high	143 Å²	143	50 Å²	50	67%	0.668	25%	0.251	S	S	*	.	H	α-helix	trans	-70.4	-43.8	-179.9	-62.5	-174.8	-179.5	0	0	111.2	E97 M101 D102 L103	E97-E99 VanDerWaalsContact C-N 3.28Å; E97-E99 PolarHBondContact O-N 2.84Å; E99-M101 VanDerWaalsContact C-N 3.35Å; E99-M101 PolarHBondContact O-N 3.37Å; E99-D102 PolarHBondContact O-N 3.43Å; E99-L103 WeakPolarHBondContact O-CG 3.14Å; E99-L103 PolarHBondContact O-N 2.58Å
100	S	93.4	Very high	91.2	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.014	23%	0.23	C	C	.	.	H	α-helix	trans	-61.9	-41.4	175.8	-65.4	0	0	0	0	112	E97 L103 V104 A122 L123	E97-S100 PolarHBondContact O-N 3.33Å; S100-L103 PolarHBondContact O-N 2.92Å; S100-V104 WeakPolarHBondContact O-CG2 3.43Å; S100-V104 PolarHBondContact O-N 3.3Å; S100-A122 VanDerWaalsContact OG-C 3.28Å; S100-A122 VanDerWaalsContact OG-CB 3.32Å; S100-A122 WeakPolarHBondContact OG-CB 3.29Å; S100-A122 PolarHBondContact OG-O 3.09Å; S100-L123 PolarHBondContact OG-N 2.75Å
101	M	93.1	Very high	91.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.5	-41.1	176	-172	65.4	-171.1	0	0	112.1	V53 V55 F61 F75 V96 E97 E99 L103 V104 L105 F130	V53-M101 HydrophobicContact CB-CE 4.26Å; V53-M101 HydrophobicContact CG1-CE 3.85Å; V53-M101 HydrophobicContact CG2-CE 4.4Å; V55-M101 HydrophobicContact CG1-CB 3.88Å; V55-M101 HydrophobicContact CG1-CG 3.76Å; V55-M101 HydrophobicContact CG1-SD 4.44Å; F61-M101 HydrophobicContact CD2-CG 3.94Å; F61-M101 HydrophobicContact CE2-CB 4Å; F61-M101 HydrophobicContact CE2-CG 3.89Å; F61-M101 HydrophobicContact CZ-CB 4.35Å; F61-M101 HydrophobicContact CZ-CG 4.47Å; F75-M101 HydrophobicContact CZ-CE 4.32Å; V96-M101 HydrophobicContact CG1-CB 4.24Å; E97-M101 PolarHBondContact O-N 2.87Å; E99-M101 VanDerWaalsContact C-N 3.35Å; E99-M101 PolarHBondContact O-N 3.37Å; M101-L103 VanDerWaalsContact C-N 3.32Å; M101-L103 PolarHBondContact O-N 3.47Å; M101-V104 PolarHBondContact O-N 3.34Å; M101-L105 HydrophobicContact CE-CD1 4.04Å; M101-L105 HydrophobicContact CE-CD2 4.03Å; M101-L105 HydrophobicContact CE-CG 3.95Å; M101-L105 HydrophobicContact CG-CD1 4.14Å; M101-L105 WeakPolarHBondContact O-CG 3.46Å; M101-L105 PolarHBondContact O-N 2.89Å; M101-F130 HydrophobicContact SD-CE2 3.67Å; M101-F130 HydrophobicContact SD-CZ 3.68Å
102	D	92.8	Very high	91.3	Very high	56 Å²	56	51.7 Å²	51.7	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-61.2	-41.2	175.9	-170.7	72	0	0	0	111.6	F61 A98 E99 L105 N106	F61-D102 HydrophobicContact CE1-CB 4.13Å; F61-D102 HydrophobicContact CZ-CB 4.31Å; A98-D102 PolarHBondContact O-N 3.27Å; A98-D102 VanDerWaalsContact O-N 3.1Å; E99-D102 PolarHBondContact O-N 3.43Å; D102-L105 PolarHBondContact O-N 3.19Å; D102-N106 VanDerWaalsContact O-CB 3.31Å; D102-N106 WeakPolarHBondContact O-CB 3.04Å; D102-N106 VanDerWaalsContact O-CG 3.28Å; D102-N106 PolarHBondContact O-N 2.97Å; D102-N106 PolarHBondContact O-ND2 3.11Å; D102-N106 VanDerWaalsContact O-ND2 3.07Å; D102-N106 PolarHBondContact OD2-ND2 3.25Å
103	L	94	Very high	91.4	Very high	28 Å²	28	45.3 Å²	45.3	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-41.4	175.2	-69.1	172.9	0	0	0	112.7	E99 S100 M101 N106 Y107 N119 L123	E99-L103 WeakPolarHBondContact O-CG 3.14Å; E99-L103 PolarHBondContact O-N 2.58Å; S100-L103 PolarHBondContact O-N 2.92Å; M101-L103 VanDerWaalsContact C-N 3.32Å; M101-L103 PolarHBondContact O-N 3.47Å; L103-N106 PolarHBondContact O-N 3.12Å; L103-Y107 WeakPolarHBondContact O-CB 3.28Å; L103-Y107 PolarHBondContact O-N 2.76Å; L103-N119 HydrophobicContact CD1-CB 4.11Å; L103-L123 HydrophobicContact CB-CD1 3.97Å; L103-L123 HydrophobicContact CB-CD2 4.35Å; L103-L123 HydrophobicContact CD1-CD2 4.19Å
104	V	94.2	Very high	91.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-42.2	175.5	172.9	0	0	0	0	111	S100 M101 Y107 A108 L123 F130 I132 I135	S100-V104 WeakPolarHBondContact O-CG2 3.43Å; S100-V104 PolarHBondContact O-N 3.3Å; M101-V104 PolarHBondContact O-N 3.34Å; V104-Y107 WeakPolarHBondContact O-CB 3.43Å; V104-Y107 PolarHBondContact O-N 2.91Å; V104-A108 WeakPolarHBondContact O-CB 3.42Å; V104-A108 PolarHBondContact O-N 3.45Å; V104-L123 HydrophobicContact CG2-CD1 3.65Å; V104-F130 HydrophobicContact CG1-CD2 4.05Å; V104-F130 HydrophobicContact CG1-CE2 4.43Å; V104-F130 HydrophobicContact CG2-CD2 4.18Å; V104-F130 HydrophobicContact CG2-CE2 4.36Å; V104-I132 HydrophobicContact CG1-CD1 3.78Å; V104-I135 HydrophobicContact CG1-CD1 4.46Å; V104-I135 HydrophobicContact CG2-CD1 4.11Å
105	L	93.1	Very high	91.8	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-45.8	176.2	-71.2	170.6	0	0	0	111.3	F61 C63 L68 M101 D102 Y107 A108 Y109	F61-L105 HydrophobicContact CB-CD1 3.69Å; F61-L105 HydrophobicContact CD1-CD1 3.6Å; F61-L105 HydrophobicContact CD2-CD1 4.45Å; F61-L105 HydrophobicContact CE1-CD1 4.3Å; F61-L105 HydrophobicContact CG-CD1 3.68Å; C63-L105 HydrophobicContact CB-CD2 4.16Å; L68-L105 HydrophobicContact CD2-CD2 3.78Å; M101-L105 HydrophobicContact CE-CD1 4.04Å; M101-L105 HydrophobicContact CE-CD2 4.03Å; M101-L105 HydrophobicContact CE-CG 3.95Å; M101-L105 HydrophobicContact CG-CD1 4.14Å; M101-L105 WeakPolarHBondContact O-CG 3.46Å; M101-L105 PolarHBondContact O-N 2.89Å; D102-L105 PolarHBondContact O-N 3.19Å; L105-Y107 VanDerWaalsContact C-N 3.26Å; L105-Y107 PolarHBondContact O-N 3.2Å; L105-A108 WeakPolarHBondContact O-CA 3.34Å; L105-A108 WeakPolarHBondContact O-CB 3.4Å; L105-A108 PolarHBondContact O-N 2.75Å; L105-Y109 HydrophobicContact CD2-CE2 4.46Å; L105-Y109 WeakPolarHBondContact O-CD2 3.33Å; L105-Y109 PolarHBondContact O-N 2.71Å; L105-Y109 VanDerWaalsContact O-N 3.09Å
106	N	92.5	Very high	92.1	Very high	46 Å²	46	48.7 Å²	48.7	25%	0.246	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-41.9	174.4	-78.6	-40.2	0	0	0	111.2	D102 L103 Y109 T110	D102-N106 VanDerWaalsContact O-CB 3.31Å; D102-N106 WeakPolarHBondContact O-CB 3.04Å; D102-N106 VanDerWaalsContact O-CG 3.28Å; D102-N106 PolarHBondContact O-N 2.97Å; D102-N106 PolarHBondContact O-ND2 3.11Å; D102-N106 VanDerWaalsContact O-ND2 3.07Å; D102-N106 PolarHBondContact OD2-ND2 3.25Å; L103-N106 PolarHBondContact O-N 3.12Å; N106-Y109 PolarHBondContact O-N 2.98Å; N106-T110 VanDerWaalsContact O-CB 3.3Å; N106-T110 WeakPolarHBondContact O-CB 3.3Å; N106-T110 WeakPolarHBondContact O-CG2 3.42Å; N106-T110 PolarHBondContact O-N 3.2Å; N106-T110 PolarHBondContact O-OG1 3.23Å
107	Y	93.9	Very high	91.9	Very high	31 Å²	31	53.5 Å²	53.5	12%	0.122	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-42.7	172.3	178.9	-110.6	0	0	0	112.2	I71 L103 V104 L105 Y109 T110 S111 I113 I132 S134 I135	I71-Y107 HydrophobicContact CD1-CD1 3.45Å; I71-Y107 VanDerWaalsContact CD1-CD1 3.45Å; I71-Y107 HydrophobicContact CD1-CE1 3.52Å; I71-Y107 HydrophobicContact CG1-CD1 4.44Å; I71-Y107 HydrophobicContact CG1-CE1 4.21Å; L103-Y107 WeakPolarHBondContact O-CB 3.28Å; L103-Y107 PolarHBondContact O-N 2.76Å; V104-Y107 WeakPolarHBondContact O-CB 3.43Å; V104-Y107 PolarHBondContact O-N 2.91Å; L105-Y107 VanDerWaalsContact C-N 3.26Å; L105-Y107 PolarHBondContact O-N 3.2Å; Y107-Y109 VanDerWaalsContact C-N 3.27Å; Y107-Y109 PolarHBondContact O-N 2.86Å; Y107-T110 PolarHBondContact O-N 3.44Å; Y107-S111 VanDerWaalsContact O-CA 3.26Å; Y107-S111 WeakPolarHBondContact O-CA 3.24Å; Y107-S111 PolarHBondContact O-N 3.07Å; Y107-I113 HydrophobicContact CD2-CD1 3.51Å; Y107-I113 HydrophobicContact CD2-CG1 3.34Å; Y107-I113 HydrophobicContact CE2-CD1 3.92Å; Y107-I113 HydrophobicContact CE2-CG1 4.09Å; Y107-I113 HydrophobicContact CG-CD1 3.87Å; Y107-I113 HydrophobicContact CG-CG1 3.86Å; Y107-I132 HydrophobicContact CE1-CG2 4.16Å; Y107-S134 VanDerWaalsContact OH-CB 3.28Å; Y107-S134 WeakPolarHBondContact OH-CB 3.45Å; Y107-I135 HydrophobicContact CD1-CD1 3.52Å; Y107-I135 HydrophobicContact CD1-CG1 3.65Å; Y107-I135 HydrophobicContact CE1-CD1 4.02Å; Y107-I135 HydrophobicContact CE1-CG1 3.68Å; Y107-I135 HydrophobicContact CG-CD1 4.09Å; Y107-I135 HydrophobicContact CG-CG1 4.18Å
108	A	92.7	Very high	91.8	Very high	8 Å²	8	53 Å²	53	7%	0.066	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-35.2	-179.7	0	0	0	0	0	113.8	V67 I71 V104 L105	V67-A108 HydrophobicContact CG1-CB 3.99Å; I71-A108 VanDerWaalsContact CD1-CA 3.44Å; I71-A108 HydrophobicContact CD1-CB 3.79Å; I71-A108 HydrophobicContact CG2-CB 4.18Å; V104-A108 WeakPolarHBondContact O-CB 3.42Å; V104-A108 PolarHBondContact O-N 3.45Å; L105-A108 WeakPolarHBondContact O-CA 3.34Å; L105-A108 WeakPolarHBondContact O-CB 3.4Å; L105-A108 PolarHBondContact O-N 2.75Å
109	Y	92.5	Very high	91.9	Very high	3 Å²	3	52.9 Å²	52.9	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-101.6	-11	-179.5	-64.9	-80.8	0	0	0	114.9	L36 L39 K40 Y43 H64 V67 L105 N106 Y107	L36-Y109 VanDerWaalsContact CG-O 3.32Å; L36-Y109 WeakPolarHBondContact CG-O 3.46Å; L39-Y109 HydrophobicContact CB-CD1 4.21Å; L39-Y109 HydrophobicContact CB-CE1 4.44Å; K40-Y109 VanDerWaalsContact CD-CB 3.44Å; K40-Y109 HydrophobicContact CD-CG 4.23Å; Y43-Y109 HydrophobicContact CD1-CD2 4.1Å; Y43-Y109 HydrophobicContact CD1-CE2 4.15Å; Y43-Y109 HydrophobicContact CD2-CD2 4.23Å; Y43-Y109 HydrophobicContact CD2-CE1 4.47Å; Y43-Y109 AromaticContact CD2-CE2 3.46Å; Y43-Y109 HydrophobicContact CD2-CE2 3.46Å; Y43-Y109 VanDerWaalsContact CD2-CE2 3.46Å; Y43-Y109 AromaticContact CD2-CZ 3.61Å; Y43-Y109 HydrophobicContact CE1-CD2 4.45Å; Y43-Y109 HydrophobicContact CE1-CE2 4.46Å; Y43-Y109 AromaticContact CE2-CE2 3.82Å; Y43-Y109 HydrophobicContact CE2-CE2 3.82Å; Y43-Y109 AromaticContact CG-CD2 3.98Å; Y43-Y109 HydrophobicContact CG-CD2 3.98Å; Y43-Y109 HydrophobicContact CG-CE1 4.3Å; Y43-Y109 AromaticContact CG-CE2 3.64Å; Y43-Y109 HydrophobicContact CG-CE2 3.64Å; Y43-Y109 HydrophobicContact CG-CG 4.48Å; Y43-Y109 AromaticContact CG-CZ 3.81Å; H64-Y109 PolarHBondContact N-OH 3.27Å; H64-Y109 AromaticContact ND1-CE1 3.56Å; H64-Y109 AromaticContact ND1-CZ 3.59Å; H64-Y109 PolarHBondContact ND1-OH 3.14Å; V67-Y109 HydrophobicContact CB-CE1 4.07Å; V67-Y109 HydrophobicContact CG1-CD1 4.1Å; V67-Y109 HydrophobicContact CG1-CE1 3.79Å; V67-Y109 HydrophobicContact CG1-CE2 4.4Å; V67-Y109 HydrophobicContact CG2-CD1 4.46Å; V67-Y109 HydrophobicContact CG2-CE1 3.79Å; L105-Y109 HydrophobicContact CD2-CE2 4.46Å; L105-Y109 WeakPolarHBondContact O-CD2 3.33Å; L105-Y109 PolarHBondContact O-N 2.71Å; L105-Y109 VanDerWaalsContact O-N 3.09Å; N106-Y109 PolarHBondContact O-N 2.98Å; Y107-Y109 VanDerWaalsContact C-N 3.27Å; Y107-Y109 PolarHBondContact O-N 2.86Å
110	T	91	Very high	91.9	Very high	51 Å²	51	46.4 Å²	46.4	31%	0.313	25%	0.251	S	S	.	.	H	α-helix	trans	-128	-14.1	-176.6	72.3	0	0	0	0	114.4	K40 N106 Y107 R112	K40-T110 HydrophobicContact CD-CG2 3.85Å; K40-T110 HydrophobicContact CG-CG2 4.28Å; N106-T110 VanDerWaalsContact O-CB 3.3Å; N106-T110 WeakPolarHBondContact O-CB 3.3Å; N106-T110 WeakPolarHBondContact O-CG2 3.42Å; N106-T110 PolarHBondContact O-N 3.2Å; N106-T110 PolarHBondContact O-OG1 3.23Å; Y107-T110 PolarHBondContact O-N 3.44Å; T110-R112 PolarHBondContact O-N 3.46Å; T110-R112 PolarHBondContact OG1-N 3.21Å
111	S	88.9	Confident	91.9	Very high	76 Å²	76	51 Å²	51	53%	0.531	27%	0.272	S	S	.	.	S	Bend	trans	55.5	24.9	-170	-50.3	0	0	0	0	113.8	Y107	Y107-S111 VanDerWaalsContact O-CA 3.26Å; Y107-S111 WeakPolarHBondContact O-CA 3.24Å; Y107-S111 PolarHBondContact O-N 3.07Å
112	R	89.8	Confident	91.9	Very high	196 Å²	196	52.1 Å²	52.1	74%	0.74	28%	0.281	S	S	*	.			trans	-120.2	143.4	177.5	-64.6	-179.9	-179.4	-164.6	-2.1	110.6	T110	T110-R112 PolarHBondContact O-N 3.46Å; T110-R112 PolarHBondContact OG1-N 3.21Å
113	I	93	Very high	92	Very high	30 Å²	30	49.4 Å²	49.4	15%	0.154	27%	0.267	C	S	.	.			trans	-133.3	137.2	178.2	-48.9	-177.5	0	0	0	107.8	Y107 L115 L123 I135	Y107-I113 HydrophobicContact CD2-CD1 3.51Å; Y107-I113 HydrophobicContact CD2-CG1 3.34Å; Y107-I113 HydrophobicContact CE2-CD1 3.92Å; Y107-I113 HydrophobicContact CE2-CG1 4.09Å; Y107-I113 HydrophobicContact CG-CD1 3.87Å; Y107-I113 HydrophobicContact CG-CG1 3.86Å; I113-L115 HydrophobicContact CG2-CD2 3.61Å; I113-L115 HydrophobicContact CG2-CG 3.98Å; I113-L123 HydrophobicContact CG2-CD2 3.66Å; I113-I135 HydrophobicContact CD1-CB 4.18Å; I113-I135 HydrophobicContact CD1-CD1 4.4Å; I113-I135 HydrophobicContact CD1-CG1 3.71Å; I113-I135 HydrophobicContact CD1-CG2 4Å
114	I	91.3	Very high	92.1	Very high	128 Å²	128	48.1 Å²	48.1	66%	0.656	26%	0.26	S	S	*	.			trans	-109.2	109.4	173.2	-59.5	171.6	0	0	0	106.9	N119	I114-N119 PolarHBondContact O-ND2 3.4Å
115	L	91.9	Very high	92.1	Very high	34 Å²	34	49.7 Å²	49.7	18%	0.178	27%	0.27	C	S	.	.			trans	-98	138.1	-178.6	-62.6	177.2	0	0	0	110.6	I113 L123 Q138 Y142	I113-L115 HydrophobicContact CG2-CD2 3.61Å; I113-L115 HydrophobicContact CG2-CG 3.98Å; L115-L123 HydrophobicContact CD2-CD2 3.59Å; L115-Q138 HydrophobicContact CD1-CB 4.35Å; L115-Y142 HydrophobicContact CB-CD2 3.82Å; L115-Y142 HydrophobicContact CB-CE2 4.1Å; L115-Y142 HydrophobicContact CB-CG 4.04Å; L115-Y142 HydrophobicContact CD1-CD2 4.32Å; L115-Y142 HydrophobicContact CD1-CG 4.13Å
116	T	90.4	Very high	92.1	Very high	59 Å²	59	49.7 Å²	49.7	36%	0.362	27%	0.27	S	S	.	.			trans	-139.5	161.9	175.9	63	0	0	0	0	108.9	A118 N119 V120	T116-A118 PolarHBondContact O-N 3.06Å; T116-N119 PolarHBondContact N-OD1 3.43Å; T116-N119 PolarHBondContact O-N 3.35Å; T116-N119 PolarHBondContact O-OD1 2.8Å; T116-N119 PolarHBondContact OG1-N 3.02Å; T116-N119 PolarHBondContact OG1-ND2 2.88Å; T116-N119 PolarHBondContact OG1-OD1 2.61Å; T116-V120 WeakPolarHBondContact O-CB 3.5Å; T116-V120 PolarHBondContact O-N 3.09Å
117	E	86.4	Confident	92.2	Very high	103 Å²	103	47.5 Å²	47.5	48%	0.481	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.4	177.7	-61.7	-169.7	159.2	0	0	112.9	Y142	E117-Y142 PolarHBondContact N-OH 3.47Å
118	A	89	Confident	92.1	Very high	96 Å²	96	47.2 Å²	47.2	79%	0.793	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-34.2	-179.7	0	0	0	0	0	113.1	T116	T116-A118 PolarHBondContact O-N 3.06Å
119	N	92.9	Very high	92.1	Very high	20 Å²	20	49.5 Å²	49.5	11%	0.107	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-20.3	-173.1	75.3	14.1	0	0	0	114.2	L103 I114 T116 Q121 A122 L123	L103-N119 HydrophobicContact CD1-CB 4.11Å; I114-N119 PolarHBondContact O-ND2 3.4Å; T116-N119 PolarHBondContact N-OD1 3.43Å; T116-N119 PolarHBondContact O-N 3.35Å; T116-N119 PolarHBondContact O-OD1 2.8Å; T116-N119 PolarHBondContact OG1-N 3.02Å; T116-N119 PolarHBondContact OG1-ND2 2.88Å; T116-N119 PolarHBondContact OG1-OD1 2.61Å; N119-Q121 PolarHBondContact O-N 3.25Å; N119-A122 PolarHBondContact O-N 3.28Å; N119-L123 VanDerWaalsContact O-CB 3.25Å; N119-L123 WeakPolarHBondContact O-CB 3.47Å; N119-L123 PolarHBondContact O-N 3.09Å
120	V	93.6	Very high	92.1	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-40.7	-166.5	64.9	0	0	0	0	112.9	T116 F124 C139 Y142 M143	T116-V120 WeakPolarHBondContact O-CB 3.5Å; T116-V120 PolarHBondContact O-N 3.09Å; V120-F124 VanDerWaalsContact O-CB 3.28Å; V120-F124 WeakPolarHBondContact O-CB 3.46Å; V120-F124 PolarHBondContact O-N 3.34Å; V120-C139 HydrophobicContact CG2-CB 3.8Å; V120-Y142 HydrophobicContact CB-CD1 4.03Å; V120-Y142 HydrophobicContact CB-CE1 4.29Å; V120-Y142 HydrophobicContact CG1-CD1 4.2Å; V120-Y142 HydrophobicContact CG1-CE1 4.25Å; V120-Y142 HydrophobicContact CG2-CD1 3.82Å; V120-Y142 HydrophobicContact CG2-CG 4.49Å; V120-M143 HydrophobicContact CG1-CG 4.18Å; V120-M143 HydrophobicContact CG2-CG 3.9Å; V120-M143 HydrophobicContact CG2-SD 4.47Å
121	Q	93	Very high	92.3	Very high	98 Å²	98	51.7 Å²	51.7	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-68.9	-49.6	-180	-68.8	-178	-19	0	0	111.2	N119 L123 F124 T125 F158	N119-Q121 PolarHBondContact O-N 3.25Å; Q121-L123 VanDerWaalsContact C-N 3.32Å; Q121-L123 PolarHBondContact O-N 3.34Å; Q121-F124 PolarHBondContact O-N 3.01Å; Q121-T125 PolarHBondContact O-N 3.4Å; Q121-T125 PolarHBondContact O-OG1 3.25Å; Q121-F158 HydrophobicContact CB-CE2 4.27Å; Q121-F158 HydrophobicContact CG-CE2 4.49Å
122	A	93.3	Very high	92.6	Very high	24 Å²	24	48.2 Å²	48.2	20%	0.198	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-39.7	179.1	0	0	0	0	0	111.9	S100 N119 T125 A126	S100-A122 VanDerWaalsContact OG-C 3.28Å; S100-A122 VanDerWaalsContact OG-CB 3.32Å; S100-A122 WeakPolarHBondContact OG-CB 3.29Å; S100-A122 PolarHBondContact OG-O 3.09Å; N119-A122 PolarHBondContact O-N 3.28Å; A122-T125 PolarHBondContact O-N 3.32Å; A122-A126 PolarHBondContact O-N 2.96Å
123	L	95.3	Very high	92.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-68	-39.5	175.5	-178.4	60.8	0	0	0	111.9	S100 L103 V104 I113 L115 N119 Q121 T125 A126 A127 I135	S100-L123 PolarHBondContact OG-N 2.75Å; L103-L123 HydrophobicContact CB-CD1 3.97Å; L103-L123 HydrophobicContact CB-CD2 4.35Å; L103-L123 HydrophobicContact CD1-CD2 4.19Å; V104-L123 HydrophobicContact CG2-CD1 3.65Å; I113-L123 HydrophobicContact CG2-CD2 3.66Å; L115-L123 HydrophobicContact CD2-CD2 3.59Å; N119-L123 VanDerWaalsContact O-CB 3.25Å; N119-L123 WeakPolarHBondContact O-CB 3.47Å; N119-L123 PolarHBondContact O-N 3.09Å; Q121-L123 VanDerWaalsContact C-N 3.32Å; Q121-L123 PolarHBondContact O-N 3.34Å; L123-T125 VanDerWaalsContact C-N 3.34Å; L123-A126 PolarHBondContact O-N 3.32Å; L123-A127 VanDerWaalsContact O-CB 3.31Å; L123-A127 WeakPolarHBondContact O-CB 3.5Å; L123-A127 PolarHBondContact O-N 3.38Å; L123-I135 HydrophobicContact CD1-CG2 4.16Å; L123-I135 HydrophobicContact CD2-CG2 4.05Å; L123-I135 HydrophobicContact CG-CG2 3.84Å
124	F	95.2	Very high	92.6	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-42.6	175.1	-174.4	-73.1	0	0	0	111.2	V120 Q121 A127 S128 Q136 C139 A140 M143 F158 Y162 H164	V120-F124 VanDerWaalsContact O-CB 3.28Å; V120-F124 WeakPolarHBondContact O-CB 3.46Å; V120-F124 PolarHBondContact O-N 3.34Å; Q121-F124 PolarHBondContact O-N 3.01Å; F124-A127 PolarHBondContact O-N 2.94Å; F124-S128 WeakPolarHBondContact CE1-OG 3.4Å; F124-S128 WeakPolarHBondContact O-CB 3.39Å; F124-S128 PolarHBondContact O-N 2.84Å; F124-S128 PolarHBondContact O-OG 3.25Å; F124-Q136 HydrophobicContact CD2-CB 4.43Å; F124-Q136 HydrophobicContact CE2-CB 4.01Å; F124-Q136 HydrophobicContact CE2-CG 4.5Å; F124-Q136 HydrophobicContact CZ-CB 4.39Å; F124-C139 HydrophobicContact CB-CB 4.02Å; F124-C139 HydrophobicContact CD2-CB 3.68Å; F124-C139 HydrophobicContact CG-CB 4.35Å; F124-A140 HydrophobicContact CE2-CB 4.34Å; F124-M143 HydrophobicContact CD2-CE 3.72Å; F124-M143 HydrophobicContact CE2-CE 4.21Å; F124-M143 HydrophobicContact CG-CE 4.26Å; F124-F158 HydrophobicContact CB-CE1 4.12Å; F124-F158 HydrophobicContact CB-CZ 3.9Å; F124-F158 AromaticContact CD1-CE1 3.32Å; F124-F158 HydrophobicContact CD1-CE1 3.32Å; F124-F158 AromaticContact CD1-CZ 3.43Å; F124-F158 HydrophobicContact CD1-CZ 3.43Å; F124-F158 VanDerWaalsContact CD1-CZ 3.43Å; F124-F158 HydrophobicContact CD2-CE1 4.25Å; F124-F158 AromaticContact CE1-CE1 3.72Å; F124-F158 HydrophobicContact CE1-CE1 3.72Å; F124-F158 HydrophobicContact CE1-CZ 4.19Å; F124-F158 AromaticContact CG-CE1 3.64Å; F124-F158 HydrophobicContact CG-CE1 3.64Å; F124-F158 AromaticContact CG-CZ 3.82Å; F124-F158 HydrophobicContact CG-CZ 3.82Å; F124-F158 HydrophobicContact CZ-CE1 4.34Å; F124-Y162 HydrophobicContact CD1-CD2 4.23Å; F124-Y162 HydrophobicContact CD1-CG 4.29Å; F124-Y162 HydrophobicContact CE1-CD1 4.23Å; F124-Y162 AromaticContact CE1-CD2 3.97Å; F124-Y162 HydrophobicContact CE1-CD2 3.97Å; F124-Y162 AromaticContact CE1-CG 3.73Å; F124-Y162 HydrophobicContact CE1-CG 3.73Å; F124-H164 AromaticContact CE2-CD2 3.89Å; F124-H164 HydrophobicContact CZ-CB 4.14Å; F124-H164 AromaticContact CZ-CD2 3.69Å
125	T	93.5	Very high	92.7	Very high	32 Å²	32	37.6 Å²	37.6	20%	0.196	22%	0.222	C	C	.	.	H	α-helix	trans	-58.6	-49.8	173.4	-62.2	0	0	0	0	111.3	Q121 A122 L123 A127 S128 I129 Y162	Q121-T125 PolarHBondContact O-N 3.4Å; Q121-T125 PolarHBondContact O-OG1 3.25Å; A122-T125 PolarHBondContact O-N 3.32Å; L123-T125 VanDerWaalsContact C-N 3.34Å; T125-A127 PolarHBondContact O-N 3.2Å; T125-S128 WeakPolarHBondContact O-CB 3.3Å; T125-S128 PolarHBondContact O-N 3.04Å; T125-S128 VanDerWaalsContact O-N 3.12Å; T125-I129 HydrophobicContact CG2-CD1 4.02Å; T125-I129 WeakPolarHBondContact O-CG1 3.32Å; T125-I129 PolarHBondContact O-N 3.23Å; T125-Y162 WeakPolarHBondContact CB-OH 3.44Å; T125-Y162 VanDerWaalsContact CG2-OH 3.24Å; T125-Y162 WeakPolarHBondContact CG2-OH 3.26Å; T125-Y162 PolarHBondContact OG1-OH 2.93Å
126	A	93.7	Very high	92.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-43.8	177.5	0	0	0	0	0	112.2	V96 A122 L123 S128 I129 F130	V96-A126 HydrophobicContact CG1-CB 3.95Å; V96-A126 HydrophobicContact CG2-CB 4.46Å; A122-A126 PolarHBondContact O-N 2.96Å; L123-A126 PolarHBondContact O-N 3.32Å; A126-S128 PolarHBondContact O-N 3.31Å; A126-I129 PolarHBondContact O-N 3.45Å; A126-F130 HydrophobicContact CB-CD2 4.38Å; A126-F130 HydrophobicContact CB-CE2 4.15Å; A126-F130 WeakPolarHBondContact O-CB 3.28Å; A126-F130 WeakPolarHBondContact O-CD2 3.16Å; A126-F130 VanDerWaalsContact O-CG 3.28Å; A126-F130 WeakPolarHBondContact O-CG 3.42Å; A126-F130 PolarHBondContact O-N 2.89Å
127	A	94.4	Very high	92.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-32.8	176.5	0	0	0	0	0	112.6	L123 F124 T125 Q131 I132 I135 Q136	L123-A127 VanDerWaalsContact O-CB 3.31Å; L123-A127 WeakPolarHBondContact O-CB 3.5Å; L123-A127 PolarHBondContact O-N 3.38Å; F124-A127 PolarHBondContact O-N 2.94Å; T125-A127 PolarHBondContact O-N 3.2Å; A127-Q131 WeakPolarHBondContact O-CA 3.37Å; A127-Q131 PolarHBondContact O-N 3.49Å; A127-I132 PolarHBondContact O-N 3.39Å; A127-I135 HydrophobicContact CB-CB 3.74Å; A127-I135 HydrophobicContact CB-CG2 3.67Å; A127-Q136 HydrophobicContact CB-CG 3.77Å
128	S	92.8	Very high	93.2	Very high	25 Å²	25	38.1 Å²	38.1	18%	0.175	22%	0.222	C	C	.	.	H	α-helix	trans	-71.6	-42.7	176.2	-54.7	0	0	0	0	111.7	F124 T125 A126 Q131 Q136	F124-S128 WeakPolarHBondContact CE1-OG 3.4Å; F124-S128 WeakPolarHBondContact O-CB 3.39Å; F124-S128 PolarHBondContact O-N 2.84Å; F124-S128 PolarHBondContact O-OG 3.25Å; T125-S128 WeakPolarHBondContact O-CB 3.3Å; T125-S128 PolarHBondContact O-N 3.04Å; T125-S128 VanDerWaalsContact O-N 3.12Å; A126-S128 PolarHBondContact O-N 3.31Å; S128-Q131 PolarHBondContact O-N 2.91Å; S128-Q136 VanDerWaalsContact CA-NE2 3.27Å; S128-Q136 PolarHBondContact OG-NE2 3.31Å
129	I	92.5	Very high	93.5	Very high	55 Å²	55	33.5 Å²	33.5	28%	0.282	18%	0.184	S	C	.	.	H	α-helix	trans	-61.2	-46.6	173.6	-66.7	166.3	0	0	0	110.3	V96 T125 A126 Q131	V96-I129 HydrophobicContact CG2-CD1 3.8Å; T125-I129 HydrophobicContact CG2-CD1 4.02Å; T125-I129 WeakPolarHBondContact O-CG1 3.32Å; T125-I129 PolarHBondContact O-N 3.23Å; A126-I129 PolarHBondContact O-N 3.45Å; I129-Q131 VanDerWaalsContact C-N 3.27Å; I129-Q131 PolarHBondContact O-N 3.3Å
130	F	93	Very high	93.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-2	-179.4	-57.4	-36.1	0	0	0	114.1	S72 Y74 F75 I93 V96 M101 V104 A126 I132	S72-F130 WeakPolarHBondContact CB-O 3.42Å; S72-F130 PolarHBondContact OG-O 3.44Å; Y74-F130 AromaticContact CD1-CD1 3.92Å; Y74-F130 HydrophobicContact CD1-CD1 3.92Å; Y74-F130 HydrophobicContact CE1-CD1 4.15Å; Y74-F130 HydrophobicContact CE1-CE1 4.39Å; F75-F130 HydrophobicContact CE2-CB 4.46Å; F75-F130 AromaticContact CE2-CD1 3.77Å; F75-F130 HydrophobicContact CE2-CD1 3.77Å; F75-F130 HydrophobicContact CE2-CD2 4.45Å; F75-F130 HydrophobicContact CE2-CE1 4.1Å; F75-F130 AromaticContact CE2-CG 3.98Å; F75-F130 HydrophobicContact CE2-CG 3.98Å; F75-F130 AromaticContact CZ-CD1 3.76Å; F75-F130 HydrophobicContact CZ-CD1 3.76Å; F75-F130 AromaticContact CZ-CE1 3.66Å; F75-F130 HydrophobicContact CZ-CE1 3.66Å; F75-F130 HydrophobicContact CZ-CG 4.38Å; F75-F130 HydrophobicContact CZ-CZ 4.16Å; I93-F130 HydrophobicContact CD1-CE1 3.74Å; I93-F130 HydrophobicContact CD1-CZ 4.04Å; I93-F130 HydrophobicContact CG2-CE1 3.92Å; I93-F130 HydrophobicContact CG2-CZ 4.19Å; V96-F130 HydrophobicContact CB-CZ 4.47Å; V96-F130 HydrophobicContact CG1-CE2 4.26Å; V96-F130 HydrophobicContact CG1-CZ 4.13Å; V96-F130 HydrophobicContact CG2-CE1 4.44Å; V96-F130 HydrophobicContact CG2-CE2 4.49Å; V96-F130 HydrophobicContact CG2-CZ 3.91Å; M101-F130 HydrophobicContact SD-CE2 3.67Å; M101-F130 HydrophobicContact SD-CZ 3.68Å; V104-F130 HydrophobicContact CG1-CD2 4.05Å; V104-F130 HydrophobicContact CG1-CE2 4.43Å; V104-F130 HydrophobicContact CG2-CD2 4.18Å; V104-F130 HydrophobicContact CG2-CE2 4.36Å; A126-F130 HydrophobicContact CB-CD2 4.38Å; A126-F130 HydrophobicContact CB-CE2 4.15Å; A126-F130 WeakPolarHBondContact O-CB 3.28Å; A126-F130 WeakPolarHBondContact O-CD2 3.16Å; A126-F130 VanDerWaalsContact O-CG 3.28Å; A126-F130 WeakPolarHBondContact O-CG 3.42Å; A126-F130 PolarHBondContact O-N 2.89Å; F130-I132 HydrophobicContact CB-CD1 3.89Å; F130-I132 HydrophobicContact CB-CG1 3.92Å; F130-I132 PolarHBondContact O-N 2.75Å
131	Q	93.9	Very high	93.5	Very high	100 Å²	100	37.4 Å²	37.4	47%	0.467	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	52.7	-179.5	-55.4	175.2	13.6	0	0	112.6	P73 A127 S128 I129 P133	P73-Q131 WeakPolarHBondContact CD-O 3.3Å; P73-Q131 HydrophobicContact CG-CB 4.43Å; A127-Q131 WeakPolarHBondContact O-CA 3.37Å; A127-Q131 PolarHBondContact O-N 3.49Å; S128-Q131 PolarHBondContact O-N 2.91Å; I129-Q131 VanDerWaalsContact C-N 3.27Å; I129-Q131 PolarHBondContact O-N 3.3Å; Q131-P133 VanDerWaalsContact O-CD 3.3Å; Q131-P133 WeakPolarHBondContact O-CD 3.41Å
132	I	94.6	Very high	93.4	Very high	3 Å²	3	35 Å²	35	2%	0.015	19%	0.189	C	C	.	.			trans	-111.9	88.1	178.1	-49.6	176.3	0	0	0	109.5	I71 V104 Y107 A127 F130 S134 I135 Q136	I71-I132 HydrophobicContact CG1-CD1 4.47Å; I71-I132 HydrophobicContact CG1-CG2 4.34Å; I71-I132 HydrophobicContact CG2-CD1 4.48Å; V104-I132 HydrophobicContact CG1-CD1 3.78Å; Y107-I132 HydrophobicContact CE1-CG2 4.16Å; A127-I132 PolarHBondContact O-N 3.39Å; F130-I132 HydrophobicContact CB-CD1 3.89Å; F130-I132 HydrophobicContact CB-CG1 3.92Å; F130-I132 PolarHBondContact O-N 2.75Å; I132-S134 VanDerWaalsContact C-N 3.29Å; I132-S134 PolarHBondContact O-N 2.83Å; I132-I135 HydrophobicContact CB-CD1 4.17Å; I132-I135 HydrophobicContact CB-CG1 4.29Å; I132-I135 HydrophobicContact CD1-CD1 4.03Å; I132-I135 HydrophobicContact CG2-CB 4.35Å; I132-I135 HydrophobicContact CG2-CD1 3.83Å; I132-I135 HydrophobicContact CG2-CG1 3.69Å; I132-I135 PolarHBondContact O-N 2.76Å; I132-I135 VanDerWaalsContact O-N 3.15Å; I132-Q136 PolarHBondContact O-N 2.94Å
133	P	91.5	Very high	93.3	Very high	73 Å²	73	34.4 Å²	34.4	47%	0.474	18%	0.182	S	C	.	.	H	α-helix	trans	-59.2	-37.2	-174.4	-25.4	34.8	0	0	0	113.5	Q131 I135 Q136 D137	Q131-P133 VanDerWaalsContact O-CD 3.3Å; Q131-P133 WeakPolarHBondContact O-CD 3.41Å; P133-I135 PolarHBondContact O-N 3.24Å; P133-I135 VanDerWaalsContact O-N 3.16Å; P133-Q136 WeakPolarHBondContact O-CA 3.41Å; P133-Q136 WeakPolarHBondContact O-CB 3.21Å; P133-Q136 PolarHBondContact O-N 3.44Å; P133-D137 VanDerWaalsContact O-CG 3.28Å; P133-D137 PolarHBondContact O-N 2.93Å
134	S	92.4	Very high	93.1	Very high	59 Å²	59	35.6 Å²	35.6	41%	0.413	19%	0.188	S	C	.	.	H	α-helix	trans	-61	-28.7	-179.3	-50.9	0	0	0	0	113.8	Y107 I132 Q138	Y107-S134 VanDerWaalsContact OH-CB 3.28Å; Y107-S134 WeakPolarHBondContact OH-CB 3.45Å; I132-S134 VanDerWaalsContact C-N 3.29Å; I132-S134 PolarHBondContact O-N 2.83Å; S134-Q138 WeakPolarHBondContact O-CG 3.34Å; S134-Q138 PolarHBondContact O-NE2 3.27Å
135	I	94.3	Very high	92.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-80	-42.6	173.5	-57.4	-179.6	0	0	0	109.6	V104 Y107 I113 L123 A127 I132 P133 D137 Q138 C139	V104-I135 HydrophobicContact CG1-CD1 4.46Å; V104-I135 HydrophobicContact CG2-CD1 4.11Å; Y107-I135 HydrophobicContact CD1-CD1 3.52Å; Y107-I135 HydrophobicContact CD1-CG1 3.65Å; Y107-I135 HydrophobicContact CE1-CD1 4.02Å; Y107-I135 HydrophobicContact CE1-CG1 3.68Å; Y107-I135 HydrophobicContact CG-CD1 4.09Å; Y107-I135 HydrophobicContact CG-CG1 4.18Å; I113-I135 HydrophobicContact CD1-CB 4.18Å; I113-I135 HydrophobicContact CD1-CD1 4.4Å; I113-I135 HydrophobicContact CD1-CG1 3.71Å; I113-I135 HydrophobicContact CD1-CG2 4Å; L123-I135 HydrophobicContact CD1-CG2 4.16Å; L123-I135 HydrophobicContact CD2-CG2 4.05Å; L123-I135 HydrophobicContact CG-CG2 3.84Å; A127-I135 HydrophobicContact CB-CB 3.74Å; A127-I135 HydrophobicContact CB-CG2 3.67Å; I132-I135 HydrophobicContact CB-CD1 4.17Å; I132-I135 HydrophobicContact CB-CG1 4.29Å; I132-I135 HydrophobicContact CD1-CD1 4.03Å; I132-I135 HydrophobicContact CG2-CB 4.35Å; I132-I135 HydrophobicContact CG2-CD1 3.83Å; I132-I135 HydrophobicContact CG2-CG1 3.69Å; I132-I135 PolarHBondContact O-N 2.76Å; I132-I135 VanDerWaalsContact O-N 3.15Å; P133-I135 PolarHBondContact O-N 3.24Å; P133-I135 VanDerWaalsContact O-N 3.16Å; I135-D137 VanDerWaalsContact C-N 3.34Å; I135-D137 PolarHBondContact O-N 3.44Å; I135-Q138 PolarHBondContact O-N 3.38Å; I135-C139 WeakPolarHBondContact O-CB 3.37Å; I135-C139 PolarHBondContact O-N 3.2Å; I135-C139 PolarHBondContact O-SG 3.47Å; I135-C139 VanDerWaalsContact O-SG 3.38Å
136	Q	93.2	Very high	92.4	Very high	39 Å²	39	38 Å²	38	18%	0.182	20%	0.202	C	C	.	.	H	α-helix	trans	-56.6	-47.4	177.1	-64.9	177.7	-56.3	0	0	111.5	F124 A127 S128 I132 P133 Q138 C139 A140	F124-Q136 HydrophobicContact CD2-CB 4.43Å; F124-Q136 HydrophobicContact CE2-CB 4.01Å; F124-Q136 HydrophobicContact CE2-CG 4.5Å; F124-Q136 HydrophobicContact CZ-CB 4.39Å; A127-Q136 HydrophobicContact CB-CG 3.77Å; S128-Q136 VanDerWaalsContact CA-NE2 3.27Å; S128-Q136 PolarHBondContact OG-NE2 3.31Å; I132-Q136 PolarHBondContact O-N 2.94Å; P133-Q136 WeakPolarHBondContact O-CA 3.41Å; P133-Q136 WeakPolarHBondContact O-CB 3.21Å; P133-Q136 PolarHBondContact O-N 3.44Å; Q136-Q138 VanDerWaalsContact C-N 3.34Å; Q136-Q138 PolarHBondContact O-N 2.88Å; Q136-C139 PolarHBondContact O-N 3.4Å; Q136-A140 VanDerWaalsContact O-CB 3.31Å; Q136-A140 WeakPolarHBondContact O-CB 3.49Å; Q136-A140 PolarHBondContact O-N 3.42Å
137	D	92.4	Very high	92.2	Very high	89 Å²	89	39 Å²	39	48%	0.476	21%	0.207	S	C	.	.	H	α-helix	trans	-62.3	-40.8	179.5	-64.4	-25	0	0	0	111.6	P133 I135 A140 Q141	P133-D137 VanDerWaalsContact O-CG 3.28Å; P133-D137 PolarHBondContact O-N 2.93Å; I135-D137 VanDerWaalsContact C-N 3.34Å; I135-D137 PolarHBondContact O-N 3.44Å; D137-A140 PolarHBondContact O-N 3.5Å; D137-Q141 VanDerWaalsContact O-CB 3.31Å; D137-Q141 WeakPolarHBondContact O-CB 3.39Å; D137-Q141 PolarHBondContact O-N 3.21Å
138	Q	93	Very high	91.9	Very high	78 Å²	78	40.3 Å²	40.3	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-67	-43.8	177	-77.5	176.5	74	0	0	111.9	L115 S134 I135 Q136 Q141 Y142	L115-Q138 HydrophobicContact CD1-CB 4.35Å; S134-Q138 WeakPolarHBondContact O-CG 3.34Å; S134-Q138 PolarHBondContact O-NE2 3.27Å; I135-Q138 PolarHBondContact O-N 3.38Å; Q136-Q138 VanDerWaalsContact C-N 3.34Å; Q136-Q138 PolarHBondContact O-N 2.88Å; Q138-Q141 PolarHBondContact O-N 3.43Å; Q138-Y142 WeakPolarHBondContact O-CB 3.47Å; Q138-Y142 PolarHBondContact O-N 3.05Å
139	C	94.8	Very high	91.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-42	175	-71.2	0	0	0	0	111.5	V120 F124 I135 Q136 Y142 M143	V120-C139 HydrophobicContact CG2-CB 3.8Å; F124-C139 HydrophobicContact CB-CB 4.02Å; F124-C139 HydrophobicContact CD2-CB 3.68Å; F124-C139 HydrophobicContact CG-CB 4.35Å; I135-C139 WeakPolarHBondContact O-CB 3.37Å; I135-C139 PolarHBondContact O-N 3.2Å; I135-C139 PolarHBondContact O-SG 3.47Å; I135-C139 VanDerWaalsContact O-SG 3.38Å; Q136-C139 PolarHBondContact O-N 3.4Å; C139-Y142 PolarHBondContact O-N 2.98Å; C139-M143 HydrophobicContact CB-CE 4.5Å; C139-M143 WeakPolarHBondContact O-CG 3.41Å; C139-M143 PolarHBondContact O-N 3.36Å
140	A	93.9	Very high	91.5	Very high	3 Å²	3	41.5 Å²	41.5	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-47.3	175.6	0	0	0	0	0	111.3	F124 Q136 D137 Y142 M143 I144 L167	F124-A140 HydrophobicContact CE2-CB 4.34Å; Q136-A140 VanDerWaalsContact O-CB 3.31Å; Q136-A140 WeakPolarHBondContact O-CB 3.49Å; Q136-A140 PolarHBondContact O-N 3.42Å; D137-A140 PolarHBondContact O-N 3.5Å; A140-Y142 VanDerWaalsContact C-N 3.3Å; A140-Y142 PolarHBondContact O-N 3.13Å; A140-M143 PolarHBondContact O-N 2.93Å; A140-I144 WeakPolarHBondContact O-CD1 3.37Å; A140-I144 VanDerWaalsContact O-CG1 3.23Å; A140-I144 WeakPolarHBondContact O-CG1 3.39Å; A140-I144 PolarHBondContact O-N 2.82Å; A140-L167 HydrophobicContact CB-CB 4.42Å; A140-L167 HydrophobicContact CB-CD1 4.5Å
141	Q	91.9	Very high	91.3	Very high	106 Å²	106	43.8 Å²	43.8	50%	0.495	23%	0.23	S	C	.	.	H	α-helix	trans	-62	-38.1	177.2	-175.4	58.5	44.6	0	0	112.1	D137 Q138 S145	D137-Q141 VanDerWaalsContact O-CB 3.31Å; D137-Q141 WeakPolarHBondContact O-CB 3.39Å; D137-Q141 PolarHBondContact O-N 3.21Å; Q138-Q141 PolarHBondContact O-N 3.43Å; Q141-S145 WeakPolarHBondContact O-CB 3.25Å; Q141-S145 PolarHBondContact O-N 2.92Å; Q141-S145 PolarHBondContact O-OG 2.86Å
142	Y	91.7	Very high	91.3	Very high	48 Å²	48	39 Å²	39	19%	0.188	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-50	173.8	-177.6	-90.6	0	0	0	111.3	L115 E117 V120 Q138 C139 A140 I144 S145 H146	L115-Y142 HydrophobicContact CB-CD2 3.82Å; L115-Y142 HydrophobicContact CB-CE2 4.1Å; L115-Y142 HydrophobicContact CB-CG 4.04Å; L115-Y142 HydrophobicContact CD1-CD2 4.32Å; L115-Y142 HydrophobicContact CD1-CG 4.13Å; E117-Y142 PolarHBondContact N-OH 3.47Å; V120-Y142 HydrophobicContact CB-CD1 4.03Å; V120-Y142 HydrophobicContact CB-CE1 4.29Å; V120-Y142 HydrophobicContact CG1-CD1 4.2Å; V120-Y142 HydrophobicContact CG1-CE1 4.25Å; V120-Y142 HydrophobicContact CG2-CD1 3.82Å; V120-Y142 HydrophobicContact CG2-CG 4.49Å; Q138-Y142 WeakPolarHBondContact O-CB 3.47Å; Q138-Y142 PolarHBondContact O-N 3.05Å; C139-Y142 PolarHBondContact O-N 2.98Å; A140-Y142 VanDerWaalsContact C-N 3.3Å; A140-Y142 PolarHBondContact O-N 3.13Å; Y142-I144 PolarHBondContact O-N 2.99Å; Y142-S145 PolarHBondContact O-N 3.4Å; Y142-S145 VanDerWaalsContact O-N 3.14Å; Y142-S145 PolarHBondContact O-OG 3.28Å; Y142-H146 AromaticContact CD2-CE1 3.7Å; Y142-H146 AromaticContact CD2-ND1 3.89Å; Y142-H146 AromaticContact CE1-ND1 3.97Å; Y142-H146 AromaticContact CE2-CE1 3.36Å; Y142-H146 WeakPolarHBondContact CE2-CE1 3.4Å; Y142-H146 AromaticContact CE2-ND1 3.78Å; Y142-H146 AromaticContact CZ-CE1 3.71Å; Y142-H146 AromaticContact CZ-ND1 3.82Å; Y142-H146 PolarHBondContact O-N 2.84Å; Y142-H146 PolarHBondContact O-ND1 2.69Å
143	M	92.3	Very high	91.2	Very high	10 Å²	10	38.9 Å²	38.9	5%	0.049	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-42.7	177.5	-72.7	-175.7	-77.4	0	0	112.1	V120 F124 C139 A140 S145 H146 L147 V155 F158 L167	V120-M143 HydrophobicContact CG1-CG 4.18Å; V120-M143 HydrophobicContact CG2-CG 3.9Å; V120-M143 HydrophobicContact CG2-SD 4.47Å; F124-M143 HydrophobicContact CD2-CE 3.72Å; F124-M143 HydrophobicContact CE2-CE 4.21Å; F124-M143 HydrophobicContact CG-CE 4.26Å; C139-M143 HydrophobicContact CB-CE 4.5Å; C139-M143 WeakPolarHBondContact O-CG 3.41Å; C139-M143 PolarHBondContact O-N 3.36Å; A140-M143 PolarHBondContact O-N 2.93Å; M143-S145 VanDerWaalsContact C-N 3.29Å; M143-S145 PolarHBondContact O-N 3.48Å; M143-H146 CarbonylContact O-C 3.52Å; M143-H146 PolarHBondContact O-N 2.83Å; M143-L147 PolarHBondContact O-N 2.83Å; M143-V155 HydrophobicContact CB-CG1 4.31Å; M143-F158 HydrophobicContact CE-CD1 4.36Å; M143-F158 HydrophobicContact CE-CE1 4.01Å; M143-F158 HydrophobicContact SD-CD1 4.39Å; M143-F158 HydrophobicContact SD-CE1 4.38Å; M143-L167 HydrophobicContact CB-CD1 3.98Å; M143-L167 HydrophobicContact CE-CD2 3.55Å; M143-L167 HydrophobicContact SD-CD2 4.29Å
144	I	90.9	Very high	91.3	Very high	25 Å²	25	36.4 Å²	36.4	13%	0.128	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-39.8	175.9	-68.6	162.9	0	0	0	111.2	A140 Y142 H146 E166 L167 R170	A140-I144 WeakPolarHBondContact O-CD1 3.37Å; A140-I144 VanDerWaalsContact O-CG1 3.23Å; A140-I144 WeakPolarHBondContact O-CG1 3.39Å; A140-I144 PolarHBondContact O-N 2.82Å; Y142-I144 PolarHBondContact O-N 2.99Å; I144-H146 VanDerWaalsContact C-N 3.29Å; I144-H146 PolarHBondContact O-N 3.09Å; I144-E166 HydrophobicContact CD1-CG 4.42Å; I144-L167 HydrophobicContact CD1-CD1 4.19Å; I144-L167 HydrophobicContact CG1-CD1 3.6Å; I144-R170 HydrophobicContact CD1-CB 4.25Å; I144-R170 HydrophobicContact CD1-CG 4.06Å; I144-R170 HydrophobicContact CG1-CB 4.08Å; I144-R170 HydrophobicContact CG1-CG 4.4Å; I144-R170 HydrophobicContact CG2-CB 4.39Å; I144-R170 HydrophobicContact CG2-CG 4.49Å
145	S	86.7	Confident	91.3	Very high	46 Å²	46	34 Å²	34	32%	0.322	18%	0.177	S	C	.	.	H	α-helix	trans	-72.9	-19.3	-179.5	65.1	0	0	0	0	114.4	Q141 Y142 M143	Q141-S145 WeakPolarHBondContact O-CB 3.25Å; Q141-S145 PolarHBondContact O-N 2.92Å; Q141-S145 PolarHBondContact O-OG 2.86Å; Y142-S145 PolarHBondContact O-N 3.4Å; Y142-S145 VanDerWaalsContact O-N 3.14Å; Y142-S145 PolarHBondContact O-OG 3.28Å; M143-S145 VanDerWaalsContact C-N 3.29Å; M143-S145 PolarHBondContact O-N 3.48Å
146	H	87.4	Confident	91.4	Very high	37 Å²	37	34 Å²	34	17%	0.171	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	28.6	-179.4	-60.7	83.5	0	0	0	112.4	Y142 M143 I144 D148 N151	Y142-H146 AromaticContact CD2-CE1 3.7Å; Y142-H146 AromaticContact CD2-ND1 3.89Å; Y142-H146 AromaticContact CE1-ND1 3.97Å; Y142-H146 AromaticContact CE2-CE1 3.36Å; Y142-H146 WeakPolarHBondContact CE2-CE1 3.4Å; Y142-H146 AromaticContact CE2-ND1 3.78Å; Y142-H146 AromaticContact CZ-CE1 3.71Å; Y142-H146 AromaticContact CZ-ND1 3.82Å; Y142-H146 PolarHBondContact O-N 2.84Å; Y142-H146 PolarHBondContact O-ND1 2.69Å; M143-H146 CarbonylContact O-C 3.52Å; M143-H146 PolarHBondContact O-N 2.83Å; I144-H146 VanDerWaalsContact C-N 3.29Å; I144-H146 PolarHBondContact O-N 3.09Å; H146-D148 PolarHBondContact O-N 3.22Å; H146-N151 PolarHBondContact O-ND2 3.46Å
147	L	89.3	Confident	91.3	Very high	24 Å²	24	34.4 Å²	34.4	13%	0.126	18%	0.18	C	C	.	.			trans	-69.3	127.1	173.9	-75.4	170.9	0	0	0	111.6	M143 V155 Y174	M143-L147 PolarHBondContact O-N 2.83Å; L147-V155 HydrophobicContact CD2-CB 4.05Å; L147-V155 HydrophobicContact CD2-CG1 4Å; L147-V155 HydrophobicContact CD2-CG2 4.24Å; L147-Y174 HydrophobicContact CB-CD1 4.45Å; L147-Y174 HydrophobicContact CB-CD2 3.87Å; L147-Y174 HydrophobicContact CB-CE2 3.97Å; L147-Y174 HydrophobicContact CB-CG 4.11Å; L147-Y174 HydrophobicContact CD1-CD2 4.32Å; L147-Y174 HydrophobicContact CD1-CG 4.23Å; L147-Y174 PolarHBondContact O-OH 3.43Å
148	D	87.1	Confident	91.4	Very high	26 Å²	26	31.5 Å²	31.5	14%	0.139	16%	0.164	C	C	.	.			trans	-132	154.5	179.6	-175.4	-93.1	0	0	0	109.4	H146 Q150 N151 S152 Y174	H146-D148 PolarHBondContact O-N 3.22Å; D148-Q150 PolarHBondContact O-N 3.23Å; D148-Q150 VanDerWaalsContact O-N 3.09Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.45Å; D148-Q150 WeakPolarHBondContact OD1-CG 3.48Å; D148-Q150 PolarHBondContact OD1-N 3.02Å; D148-N151 PolarHBondContact N-OD1 3.34Å; D148-N151 PolarHBondContact O-N 3.02Å; D148-N151 VanDerWaalsContact O-N 3.13Å; D148-N151 PolarHBondContact O-OD1 2.95Å; D148-S152 VanDerWaalsContact O-CB 3.25Å; D148-S152 WeakPolarHBondContact O-CB 3.47Å; D148-S152 PolarHBondContact O-N 3.03Å; D148-S152 PolarHBondContact O-OG 3.36Å; D148-Y174 WeakPolarHBondContact CA-OH 3.48Å
149	P	87.5	Confident	91.5	Very high	24 Å²	24	27.9 Å²	27.9	16%	0.156	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.3	177.5	-27.5	38.5	0	0	0	113.3	S152 Y174 C181 V182	P149-S152 PolarHBondContact O-OG 3.22Å; P149-Y174 VanDerWaalsContact CD-OH 3.31Å; P149-Y174 WeakPolarHBondContact CD-OH 3.31Å; P149-C181 HydrophobicContact CB-CB 4.02Å; P149-C181 HydrophobicContact CG-CB 4.1Å; P149-V182 HydrophobicContact CB-CG2 4.17Å
150	Q	88.8	Confident	91.3	Very high	82 Å²	82	32 Å²	32	38%	0.383	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-30.7	-179.6	-60.1	-165.5	-30.1	0	0	114.2	D148 E185 E187	D148-Q150 PolarHBondContact O-N 3.23Å; D148-Q150 VanDerWaalsContact O-N 3.09Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.45Å; D148-Q150 WeakPolarHBondContact OD1-CG 3.48Å; D148-Q150 PolarHBondContact OD1-N 3.02Å; Q150-E185 HydrophobicContact CG-CG 4.42Å; Q150-E187 VanDerWaalsContact O-OE2 3.11Å
151	N	90.5	Very high	91.2	Very high	47 Å²	47	38.7 Å²	38.7	25%	0.251	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-12.5	-175.3	72.1	18.8	0	0	0	113.8	H146 D148 I153 G154 V155	H146-N151 PolarHBondContact O-ND2 3.46Å; D148-N151 PolarHBondContact N-OD1 3.34Å; D148-N151 PolarHBondContact O-N 3.02Å; D148-N151 VanDerWaalsContact O-N 3.13Å; D148-N151 PolarHBondContact O-OD1 2.95Å; N151-I153 VanDerWaalsContact C-N 3.29Å; N151-I153 PolarHBondContact O-N 3.34Å; N151-G154 PolarHBondContact O-N 3.46Å; N151-V155 WeakPolarHBondContact O-CG2 3.44Å; N151-V155 PolarHBondContact O-N 3.34Å
152	S	92.3	Very high	91.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-34.5	-169.7	60.2	0	0	0	0	113.5	D148 P149 F156	D148-S152 VanDerWaalsContact O-CB 3.25Å; D148-S152 WeakPolarHBondContact O-CB 3.47Å; D148-S152 PolarHBondContact O-N 3.03Å; D148-S152 PolarHBondContact O-OG 3.36Å; P149-S152 PolarHBondContact O-OG 3.22Å; S152-F156 WeakPolarHBondContact O-CB 3.29Å; S152-F156 PolarHBondContact O-N 3.15Å
153	I	93.5	Very high	91	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-72.3	-46.6	177.1	-62.7	-62.3	0	0	0	110.5	N151 V155 F156 I157 I175 V182 E187 F188 L191	N151-I153 VanDerWaalsContact C-N 3.29Å; N151-I153 PolarHBondContact O-N 3.34Å; I153-V155 VanDerWaalsContact C-N 3.34Å; I153-V155 PolarHBondContact O-N 2.76Å; I153-F156 WeakPolarHBondContact O-CB 3.36Å; I153-F156 PolarHBondContact O-N 2.95Å; I153-F156 VanDerWaalsContact O-N 3.11Å; I153-I157 HydrophobicContact CG2-CD1 3.75Å; I153-I157 HydrophobicContact CG2-CG1 4.33Å; I153-I157 WeakPolarHBondContact O-CG1 3.48Å; I153-I157 PolarHBondContact O-N 3.47Å; I153-I175 HydrophobicContact CD1-CD1 3.67Å; I153-I175 HydrophobicContact CD1-CG1 3.94Å; I153-I175 HydrophobicContact CD1-CG2 4.2Å; I153-V182 HydrophobicContact CD1-CG1 3.54Å; I153-V182 HydrophobicContact CG1-CG1 3.48Å; I153-V182 VanDerWaalsContact CG1-CG1 3.48Å; I153-E187 HydrophobicContact CB-CB 3.81Å; I153-E187 HydrophobicContact CG2-CB 3.95Å; I153-E187 WeakPolarHBondContact CG2-O 3.41Å; I153-F188 HydrophobicContact CD1-CD2 4.42Å; I153-L191 HydrophobicContact CD1-CD1 4.19Å; I153-L191 HydrophobicContact CD1-CD2 4.48Å; I153-L191 HydrophobicContact CG2-CD2 3.78Å; I153-L191 HydrophobicContact CG2-CG 4.02Å
154	G	92.7	Very high	91	Very high	21 Å²	21	38 Å²	38	22%	0.216	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-45.2	175.8	0	0	0	0	0	112.2	N151 F156 I157 F158 E187	N151-G154 PolarHBondContact O-N 3.46Å; G154-F156 VanDerWaalsContact C-N 3.32Å; G154-F156 PolarHBondContact O-N 2.97Å; G154-I157 PolarHBondContact O-N 3.21Å; G154-F158 WeakPolarHBondContact O-CB 2.95Å; G154-F158 PolarHBondContact O-N 3.4Å; G154-E187 WeakPolarHBondContact CA-OE2 3.35Å; G154-E187 PolarHBondContact N-OE2 3.43Å
155	V	93.8	Very high	91.1	Very high	8 Å²	8	43.3 Å²	43.3	5%	0.048	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-38.3	175	175.7	0	0	0	0	111.4	M143 L147 N151 I153 F158 A159 L167	M143-V155 HydrophobicContact CB-CG1 4.31Å; L147-V155 HydrophobicContact CD2-CB 4.05Å; L147-V155 HydrophobicContact CD2-CG1 4Å; L147-V155 HydrophobicContact CD2-CG2 4.24Å; N151-V155 WeakPolarHBondContact O-CG2 3.44Å; N151-V155 PolarHBondContact O-N 3.34Å; I153-V155 VanDerWaalsContact C-N 3.34Å; I153-V155 PolarHBondContact O-N 2.76Å; V155-F158 PolarHBondContact O-N 3.41Å; V155-A159 WeakPolarHBondContact O-CB 3.23Å; V155-A159 PolarHBondContact O-N 3.23Å; V155-L167 HydrophobicContact CG1-CD1 3.69Å; V155-L167 HydrophobicContact CG1-CD2 4.25Å; V155-L167 HydrophobicContact CG1-CG 3.98Å
156	F	95.1	Very high	91.3	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-49	175.8	168.3	-122.5	0	0	0	112.3	S152 I153 G154 F158 A159 D160 S171 K172 I175 L191 Q195 I199	S152-F156 WeakPolarHBondContact O-CB 3.29Å; S152-F156 PolarHBondContact O-N 3.15Å; I153-F156 WeakPolarHBondContact O-CB 3.36Å; I153-F156 PolarHBondContact O-N 2.95Å; I153-F156 VanDerWaalsContact O-N 3.11Å; G154-F156 VanDerWaalsContact C-N 3.32Å; G154-F156 PolarHBondContact O-N 2.97Å; F156-F158 VanDerWaalsContact C-N 3.27Å; F156-F158 PolarHBondContact O-N 2.84Å; F156-A159 PolarHBondContact O-N 2.69Å; F156-D160 PolarHBondContact O-N 3.14Å; F156-S171 WeakPolarHBondContact CA-OG 3.37Å; F156-S171 WeakPolarHBondContact CB-OG 3.43Å; F156-K172 HydrophobicContact CD2-CG 3.76Å; F156-K172 HydrophobicContact CE2-CD 3.97Å; F156-K172 HydrophobicContact CE2-CG 3.68Å; F156-K172 HydrophobicContact CG-CG 4.48Å; F156-K172 HydrophobicContact CZ-CD 4.42Å; F156-K172 HydrophobicContact CZ-CG 4.22Å; F156-I175 HydrophobicContact CB-CD1 3.78Å; F156-I175 HydrophobicContact CD1-CD1 4.17Å; F156-I175 HydrophobicContact CG-CD1 4.05Å; F156-L191 HydrophobicContact CD1-CD2 4.17Å; F156-L191 HydrophobicContact CE1-CD2 4.19Å; F156-Q195 HydrophobicContact CE1-CB 3.91Å; F156-Q195 HydrophobicContact CE1-CG 4.04Å; F156-Q195 HydrophobicContact CZ-CB 4.29Å; F156-Q195 HydrophobicContact CZ-CG 4.1Å; F156-I199 HydrophobicContact CD1-CD1 4.04Å; F156-I199 HydrophobicContact CE1-CD1 3.79Å; F156-I199 HydrophobicContact CE1-CG1 4.35Å
157	I	92.9	Very high	91.7	Very high	46 Å²	46	43.9 Å²	43.9	24%	0.236	23%	0.228	C	C	.	.	H	α-helix	trans	-60.2	-41.6	176.7	-66.1	167.7	0	0	0	110.2	I153 G154 D160 H161 L191	I153-I157 HydrophobicContact CG2-CD1 3.75Å; I153-I157 HydrophobicContact CG2-CG1 4.33Å; I153-I157 WeakPolarHBondContact O-CG1 3.48Å; I153-I157 PolarHBondContact O-N 3.47Å; G154-I157 PolarHBondContact O-N 3.21Å; I157-D160 PolarHBondContact O-N 3.03Å; I157-H161 PolarHBondContact O-N 2.89Å; I157-L191 HydrophobicContact CD1-CD2 4.3Å; I157-L191 HydrophobicContact CG1-CD2 4.26Å
158	F	93.4	Very high	91.9	Very high	29 Å²	29	43.1 Å²	43.1	13%	0.127	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-46.6	176.5	-176.7	-90	0	0	0	111.8	Q121 F124 M143 G154 V155 F156 D160 H161 Y162 L167	Q121-F158 HydrophobicContact CB-CE2 4.27Å; Q121-F158 HydrophobicContact CG-CE2 4.49Å; F124-F158 HydrophobicContact CB-CE1 4.12Å; F124-F158 HydrophobicContact CB-CZ 3.9Å; F124-F158 AromaticContact CD1-CE1 3.32Å; F124-F158 HydrophobicContact CD1-CE1 3.32Å; F124-F158 AromaticContact CD1-CZ 3.43Å; F124-F158 HydrophobicContact CD1-CZ 3.43Å; F124-F158 VanDerWaalsContact CD1-CZ 3.43Å; F124-F158 HydrophobicContact CD2-CE1 4.25Å; F124-F158 AromaticContact CE1-CE1 3.72Å; F124-F158 HydrophobicContact CE1-CE1 3.72Å; F124-F158 HydrophobicContact CE1-CZ 4.19Å; F124-F158 AromaticContact CG-CE1 3.64Å; F124-F158 HydrophobicContact CG-CE1 3.64Å; F124-F158 AromaticContact CG-CZ 3.82Å; F124-F158 HydrophobicContact CG-CZ 3.82Å; F124-F158 HydrophobicContact CZ-CE1 4.34Å; M143-F158 HydrophobicContact CE-CD1 4.36Å; M143-F158 HydrophobicContact CE-CE1 4.01Å; M143-F158 HydrophobicContact SD-CD1 4.39Å; M143-F158 HydrophobicContact SD-CE1 4.38Å; G154-F158 WeakPolarHBondContact O-CB 2.95Å; G154-F158 PolarHBondContact O-N 3.4Å; V155-F158 PolarHBondContact O-N 3.41Å; F156-F158 VanDerWaalsContact C-N 3.27Å; F156-F158 PolarHBondContact O-N 2.84Å; F158-D160 VanDerWaalsContact C-N 3.33Å; F158-D160 PolarHBondContact O-N 3.19Å; F158-H161 WeakPolarHBondContact O-CB 3.28Å; F158-H161 PolarHBondContact O-N 2.76Å; F158-Y162 HydrophobicContact CD1-CD2 4.13Å; F158-Y162 HydrophobicContact CD1-CE2 4.49Å; F158-Y162 HydrophobicContact CD2-CD2 4.23Å; F158-Y162 AromaticContact CD2-CE2 3.85Å; F158-Y162 HydrophobicContact CD2-CE2 3.85Å; F158-Y162 AromaticContact CE1-CD2 3.84Å; F158-Y162 HydrophobicContact CE1-CD2 3.84Å; F158-Y162 HydrophobicContact CE1-CE2 4.06Å; F158-Y162 AromaticContact CE2-CD2 3.97Å; F158-Y162 HydrophobicContact CE2-CD2 3.97Å; F158-Y162 AromaticContact CE2-CE2 3.36Å; F158-Y162 HydrophobicContact CE2-CE2 3.36Å; F158-Y162 HydrophobicContact CG-CD2 4.31Å; F158-Y162 HydrophobicContact CG-CE2 4.39Å; F158-Y162 AromaticContact CZ-CD2 3.75Å; F158-Y162 HydrophobicContact CZ-CD2 3.75Å; F158-Y162 AromaticContact CZ-CE2 3.47Å; F158-Y162 HydrophobicContact CZ-CE2 3.47Å; F158-Y162 VanDerWaalsContact CZ-CE2 3.47Å; F158-Y162 WeakPolarHBondContact O-CD2 3.39Å; F158-Y162 PolarHBondContact O-N 3.2Å; F158-L167 HydrophobicContact CD1-CD2 4.33Å
159	A	94.6	Very high	92.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-39.9	178.3	0	0	0	0	0	112.7	V155 F156 Y162 G163 H164 L167	V155-A159 WeakPolarHBondContact O-CB 3.23Å; V155-A159 PolarHBondContact O-N 3.23Å; F156-A159 PolarHBondContact O-N 2.69Å; A159-Y162 PolarHBondContact O-N 3.16Å; A159-G163 PolarHBondContact O-N 3.21Å; A159-H164 PolarHBondContact O-N 3Å; A159-L167 HydrophobicContact CB-CB 3.91Å; A159-L167 HydrophobicContact CB-CD2 3.84Å; A159-L167 HydrophobicContact CB-CG 3.74Å
160	D	91.8	Very high	92.3	Very high	86 Å²	86	50.5 Å²	50.5	46%	0.46	26%	0.256	S	S	.	.	H	α-helix	trans	-64.3	-42	176.4	-166.4	53.2	0	0	0	111.3	F156 I157 F158 Y162 G163 Q195	F156-D160 PolarHBondContact O-N 3.14Å; I157-D160 PolarHBondContact O-N 3.03Å; F158-D160 VanDerWaalsContact C-N 3.33Å; F158-D160 PolarHBondContact O-N 3.19Å; D160-Y162 PolarHBondContact O-N 3.15Å; D160-G163 PolarHBondContact O-N 3.31Å; D160-Q195 PolarHBondContact OD2-NE2 3.28Å
161	H	90.9	Very high	92.6	Very high	144 Å²	144	46.6 Å²	46.6	67%	0.667	24%	0.237	S	C	*	.	H	α-helix	trans	-60	-42.5	177.1	-175.8	82.7	0	0	0	113.3	I157 F158	I157-H161 PolarHBondContact O-N 2.89Å; F158-H161 WeakPolarHBondContact O-CB 3.28Å; F158-H161 PolarHBondContact O-N 2.76Å
162	Y	90.6	Very high	92.7	Very high	79 Å²	79	46.2 Å²	46.2	31%	0.31	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	0.3	178.3	-68.9	-81.7	0	0	0	113.7	F124 T125 F158 A159 D160 H164	F124-Y162 HydrophobicContact CD1-CD2 4.23Å; F124-Y162 HydrophobicContact CD1-CG 4.29Å; F124-Y162 HydrophobicContact CE1-CD1 4.23Å; F124-Y162 AromaticContact CE1-CD2 3.97Å; F124-Y162 HydrophobicContact CE1-CD2 3.97Å; F124-Y162 AromaticContact CE1-CG 3.73Å; F124-Y162 HydrophobicContact CE1-CG 3.73Å; T125-Y162 WeakPolarHBondContact CB-OH 3.44Å; T125-Y162 VanDerWaalsContact CG2-OH 3.24Å; T125-Y162 WeakPolarHBondContact CG2-OH 3.26Å; T125-Y162 PolarHBondContact OG1-OH 2.93Å; F158-Y162 HydrophobicContact CD1-CD2 4.13Å; F158-Y162 HydrophobicContact CD1-CE2 4.49Å; F158-Y162 HydrophobicContact CD2-CD2 4.23Å; F158-Y162 AromaticContact CD2-CE2 3.85Å; F158-Y162 HydrophobicContact CD2-CE2 3.85Å; F158-Y162 AromaticContact CE1-CD2 3.84Å; F158-Y162 HydrophobicContact CE1-CD2 3.84Å; F158-Y162 HydrophobicContact CE1-CE2 4.06Å; F158-Y162 AromaticContact CE2-CD2 3.97Å; F158-Y162 HydrophobicContact CE2-CD2 3.97Å; F158-Y162 AromaticContact CE2-CE2 3.36Å; F158-Y162 HydrophobicContact CE2-CE2 3.36Å; F158-Y162 HydrophobicContact CG-CD2 4.31Å; F158-Y162 HydrophobicContact CG-CE2 4.39Å; F158-Y162 AromaticContact CZ-CD2 3.75Å; F158-Y162 HydrophobicContact CZ-CD2 3.75Å; F158-Y162 AromaticContact CZ-CE2 3.47Å; F158-Y162 HydrophobicContact CZ-CE2 3.47Å; F158-Y162 VanDerWaalsContact CZ-CE2 3.47Å; F158-Y162 WeakPolarHBondContact O-CD2 3.39Å; F158-Y162 PolarHBondContact O-N 3.2Å; A159-Y162 PolarHBondContact O-N 3.16Å; D160-Y162 PolarHBondContact O-N 3.15Å; Y162-H164 PolarHBondContact O-N 3.24Å
163	G	89.8	Confident	92.6	Very high	41 Å²	41	49.6 Å²	49.6	42%	0.423	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	19.8	-178.9	0	0	0	0	0	114.7	A159 D160 Q165	A159-G163 PolarHBondContact O-N 3.21Å; D160-G163 PolarHBondContact O-N 3.31Å; G163-Q165 PolarHBondContact O-N 3.01Å; G163-Q165 VanDerWaalsContact O-N 3.11Å; G163-Q165 PolarHBondContact O-NE2 2.89Å
164	H	91.6	Very high	92.5	Very high	30 Å²	30	52.3 Å²	52.3	14%	0.139	26%	0.26	C	S	.	.			trans	-79.1	95.8	-176.9	-169.8	-56.8	0	0	0	110.9	F124 A159 Y162 E166 L167 G168	F124-H164 AromaticContact CE2-CD2 3.89Å; F124-H164 HydrophobicContact CZ-CB 4.14Å; F124-H164 AromaticContact CZ-CD2 3.69Å; A159-H164 PolarHBondContact O-N 3Å; Y162-H164 PolarHBondContact O-N 3.24Å; H164-E166 PolarHBondContact O-N 2.73Å; H164-L167 HydrophobicContact CB-CB 4.45Å; H164-L167 PolarHBondContact ND1-N 2.94Å; H164-L167 PolarHBondContact O-N 3.14Å; H164-G168 PolarHBondContact O-N 3.19Å
165	Q	92.3	Very high	92.5	Very high	137 Å²	137	51.3 Å²	51.3	64%	0.64	25%	0.25	S	C	*	.	H	α-helix	trans	-58.2	-47.6	-170.3	-61.1	-59.5	-55	0	0	114	G163 L167 G168 D169	G163-Q165 PolarHBondContact O-N 3.01Å; G163-Q165 VanDerWaalsContact O-N 3.11Å; G163-Q165 PolarHBondContact O-NE2 2.89Å; Q165-L167 PolarHBondContact O-N 3.43Å; Q165-G168 PolarHBondContact O-N 3.39Å; Q165-D169 PolarHBondContact O-N 3.46Å
166	E	92.6	Very high	92.4	Very high	95 Å²	95	53.8 Å²	53.8	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-46.8	-176.2	178.3	172.2	-164.5	0	0	112.5	I144 H164 G168 D169 R170	I144-E166 HydrophobicContact CD1-CG 4.42Å; H164-E166 PolarHBondContact O-N 2.73Å; E166-G168 VanDerWaalsContact C-N 3.32Å; E166-G168 PolarHBondContact O-N 3.31Å; E166-D169 PolarHBondContact O-N 2.8Å; E166-R170 HydrophobicContact CG-CG 4.39Å; E166-R170 WeakPolarHBondContact O-CB 3.16Å; E166-R170 VanDerWaalsContact O-CG 3.24Å; E166-R170 WeakPolarHBondContact O-CG 3.46Å; E166-R170 PolarHBondContact O-N 3.44Å; E166-R170 IonicContact OE1-NH2 2.69Å; E166-R170 PolarHBondContact OE1-NH2 3.42Å
167	L	94.2	Very high	92	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-40.9	174.9	-174.2	64.1	0	0	0	111.9	A140 M143 I144 V155 F158 A159 H164 Q165 S171	A140-L167 HydrophobicContact CB-CB 4.42Å; A140-L167 HydrophobicContact CB-CD1 4.5Å; M143-L167 HydrophobicContact CB-CD1 3.98Å; M143-L167 HydrophobicContact CE-CD2 3.55Å; M143-L167 HydrophobicContact SD-CD2 4.29Å; I144-L167 HydrophobicContact CD1-CD1 4.19Å; I144-L167 HydrophobicContact CG1-CD1 3.6Å; V155-L167 HydrophobicContact CG1-CD1 3.69Å; V155-L167 HydrophobicContact CG1-CD2 4.25Å; V155-L167 HydrophobicContact CG1-CG 3.98Å; F158-L167 HydrophobicContact CD1-CD2 4.33Å; A159-L167 HydrophobicContact CB-CB 3.91Å; A159-L167 HydrophobicContact CB-CD2 3.84Å; A159-L167 HydrophobicContact CB-CG 3.74Å; H164-L167 HydrophobicContact CB-CB 4.45Å; H164-L167 PolarHBondContact ND1-N 2.94Å; H164-L167 PolarHBondContact O-N 3.14Å; Q165-L167 PolarHBondContact O-N 3.43Å; L167-S171 VanDerWaalsContact O-CB 3.3Å; L167-S171 WeakPolarHBondContact O-CB 3.36Å; L167-S171 PolarHBondContact O-N 2.84Å; L167-S171 PolarHBondContact O-OG 2.81Å
168	G	93.5	Very high	91.8	Very high	8 Å²	8	55.4 Å²	55.4	8%	0.082	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-45.2	176.8	0	0	0	0	0	112.7	H164 Q165 E166 S171 K172	H164-G168 PolarHBondContact O-N 3.19Å; Q165-G168 PolarHBondContact O-N 3.39Å; E166-G168 VanDerWaalsContact C-N 3.32Å; E166-G168 PolarHBondContact O-N 3.31Å; G168-S171 WeakPolarHBondContact CA-OG 3.46Å; G168-S171 PolarHBondContact O-OG 3.01Å; G168-K172 WeakPolarHBondContact O-CB 3.46Å; G168-K172 VanDerWaalsContact O-CG 3.27Å; G168-K172 WeakPolarHBondContact O-CG 3.43Å; G168-K172 PolarHBondContact O-N 2.96Å
169	D	92.4	Very high	91.6	Very high	97 Å²	97	54 Å²	54	52%	0.519	26%	0.257	S	S	.	.	H	α-helix	trans	-68	-42.2	179.6	-71.6	-25.3	0	0	0	111.9	Q165 E166 K172 E173	Q165-D169 PolarHBondContact O-N 3.46Å; E166-D169 PolarHBondContact O-N 2.8Å; D169-K172 PolarHBondContact O-N 3.3Å; D169-E173 WeakPolarHBondContact O-CB 3.45Å; D169-E173 PolarHBondContact O-N 2.92Å
170	R	91.8	Very high	91.3	Very high	108 Å²	108	56.8 Å²	56.8	41%	0.408	27%	0.272	S	S	.	.	H	α-helix	trans	-67.5	-39.6	178.1	-67.1	-61.4	-172.1	87.7	20.5	112.6	I144 E166 E173 Y174	I144-R170 HydrophobicContact CD1-CB 4.25Å; I144-R170 HydrophobicContact CD1-CG 4.06Å; I144-R170 HydrophobicContact CG1-CB 4.08Å; I144-R170 HydrophobicContact CG1-CG 4.4Å; I144-R170 HydrophobicContact CG2-CB 4.39Å; I144-R170 HydrophobicContact CG2-CG 4.49Å; E166-R170 HydrophobicContact CG-CG 4.39Å; E166-R170 WeakPolarHBondContact O-CB 3.16Å; E166-R170 VanDerWaalsContact O-CG 3.24Å; E166-R170 WeakPolarHBondContact O-CG 3.46Å; E166-R170 PolarHBondContact O-N 3.44Å; E166-R170 IonicContact OE1-NH2 2.69Å; E166-R170 PolarHBondContact OE1-NH2 3.42Å; R170-E173 PolarHBondContact O-N 3.43Å; R170-Y174 PolarHBondContact O-N 3.24Å
171	S	94.4	Very high	91.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-43.9	174.7	55	0	0	0	0	111.3	F156 L167 G168 E173 Y174 I175	F156-S171 WeakPolarHBondContact CA-OG 3.37Å; F156-S171 WeakPolarHBondContact CB-OG 3.43Å; L167-S171 VanDerWaalsContact O-CB 3.3Å; L167-S171 WeakPolarHBondContact O-CB 3.36Å; L167-S171 PolarHBondContact O-N 2.84Å; L167-S171 PolarHBondContact O-OG 2.81Å; G168-S171 WeakPolarHBondContact CA-OG 3.46Å; G168-S171 PolarHBondContact O-OG 3.01Å; S171-E173 PolarHBondContact O-N 3.02Å; S171-Y174 WeakPolarHBondContact O-CB 3.47Å; S171-Y174 PolarHBondContact O-N 2.98Å; S171-I175 WeakPolarHBondContact O-CD1 3.28Å; S171-I175 VanDerWaalsContact O-CG1 3.24Å; S171-I175 WeakPolarHBondContact O-CG1 3.35Å; S171-I175 PolarHBondContact O-N 2.94Å
172	K	92.9	Very high	91.2	Very high	39 Å²	39	47.3 Å²	47.3	17%	0.17	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-44.7	171.8	-75.8	-178.5	-169.4	-175.1	0	112.5	F156 G168 D169 Y174 I175 R176 S198	F156-K172 HydrophobicContact CD2-CG 3.76Å; F156-K172 HydrophobicContact CE2-CD 3.97Å; F156-K172 HydrophobicContact CE2-CG 3.68Å; F156-K172 HydrophobicContact CG-CG 4.48Å; F156-K172 HydrophobicContact CZ-CD 4.42Å; F156-K172 HydrophobicContact CZ-CG 4.22Å; G168-K172 WeakPolarHBondContact O-CB 3.46Å; G168-K172 VanDerWaalsContact O-CG 3.27Å; G168-K172 WeakPolarHBondContact O-CG 3.43Å; G168-K172 PolarHBondContact O-N 2.96Å; D169-K172 PolarHBondContact O-N 3.3Å; K172-Y174 VanDerWaalsContact C-N 3.33Å; K172-Y174 PolarHBondContact O-N 3.28Å; K172-I175 PolarHBondContact O-N 3.28Å; K172-R176 VanDerWaalsContact O-CG 3.29Å; K172-R176 WeakPolarHBondContact O-CG 3.43Å; K172-R176 PolarHBondContact O-N 2.9Å; K172-S198 PolarHBondContact NZ-OG 3.21Å
173	E	90.9	Very high	91.1	Very high	71 Å²	71	44.5 Å²	44.5	33%	0.332	22%	0.219	S	C	.	.	H	α-helix	trans	-60.6	-43.3	177.5	-170.4	-173	170.9	0	0	111.3	D169 R170 S171 R176 K177	D169-E173 WeakPolarHBondContact O-CB 3.45Å; D169-E173 PolarHBondContact O-N 2.92Å; R170-E173 PolarHBondContact O-N 3.43Å; S171-E173 PolarHBondContact O-N 3.02Å; E173-R176 PolarHBondContact O-N 2.82Å; E173-K177 HydrophobicContact CG-CD 4.32Å; E173-K177 WeakPolarHBondContact O-CG 3.49Å; E173-K177 PolarHBondContact O-N 3.46Å; E173-K177 VanDerWaalsContact OE1-CE 3.23Å; E173-K177 WeakPolarHBondContact OE1-CE 3.39Å; E173-K177 IonicContact OE1-NZ 3.43Å; E173-K177 PolarHBondContact OE1-NZ 3.23Å
174	Y	90.9	Very high	91.1	Very high	56 Å²	56	49.4 Å²	49.4	22%	0.22	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-47.4	176.2	-173.2	-84.3	0	0	0	111.9	L147 D148 P149 R170 S171 K172 R176 K177 K178	L147-Y174 HydrophobicContact CB-CD1 4.45Å; L147-Y174 HydrophobicContact CB-CD2 3.87Å; L147-Y174 HydrophobicContact CB-CE2 3.97Å; L147-Y174 HydrophobicContact CB-CG 4.11Å; L147-Y174 HydrophobicContact CD1-CD2 4.32Å; L147-Y174 HydrophobicContact CD1-CG 4.23Å; L147-Y174 PolarHBondContact O-OH 3.43Å; D148-Y174 WeakPolarHBondContact CA-OH 3.48Å; P149-Y174 VanDerWaalsContact CD-OH 3.31Å; P149-Y174 WeakPolarHBondContact CD-OH 3.31Å; R170-Y174 PolarHBondContact O-N 3.24Å; S171-Y174 WeakPolarHBondContact O-CB 3.47Å; S171-Y174 PolarHBondContact O-N 2.98Å; K172-Y174 VanDerWaalsContact C-N 3.33Å; K172-Y174 PolarHBondContact O-N 3.28Å; Y174-R176 VanDerWaalsContact C-N 3.29Å; Y174-R176 PolarHBondContact O-N 3.13Å; Y174-K177 PolarHBondContact O-N 3.09Å; Y174-K177 VanDerWaalsContact O-N 3.15Å; Y174-K178 HydrophobicContact CE1-CB 4.23Å; Y174-K178 HydrophobicContact CE1-CG 4.27Å; Y174-K178 PolarHBondContact O-N 3.34Å
175	I	92.9	Very high	91.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-43.1	177.5	-65.9	157.3	0	0	0	110.5	I153 F156 S171 K172 K177 K178 F179 V182 I199	I153-I175 HydrophobicContact CD1-CD1 3.67Å; I153-I175 HydrophobicContact CD1-CG1 3.94Å; I153-I175 HydrophobicContact CD1-CG2 4.2Å; F156-I175 HydrophobicContact CB-CD1 3.78Å; F156-I175 HydrophobicContact CD1-CD1 4.17Å; F156-I175 HydrophobicContact CG-CD1 4.05Å; S171-I175 WeakPolarHBondContact O-CD1 3.28Å; S171-I175 VanDerWaalsContact O-CG1 3.24Å; S171-I175 WeakPolarHBondContact O-CG1 3.35Å; S171-I175 PolarHBondContact O-N 2.94Å; K172-I175 PolarHBondContact O-N 3.28Å; I175-K177 PolarHBondContact O-N 3.06Å; I175-K178 CarbonylContact O-C 3.56Å; I175-K178 PolarHBondContact O-N 3.11Å; I175-F179 WeakPolarHBondContact O-CA 3.38Å; I175-F179 WeakPolarHBondContact O-CB 3.4Å; I175-F179 PolarHBondContact O-N 3.27Å; I175-V182 HydrophobicContact CG2-CG1 4.24Å; I175-I199 HydrophobicContact CD1-CD1 4.35Å; I175-I199 HydrophobicContact CG2-CD1 4.34Å; I175-I199 HydrophobicContact CG2-CG2 3.81Å
176	R	90.8	Very high	90.9	Very high	61 Å²	61	51.6 Å²	51.6	23%	0.23	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-41.8	177.5	-71	168.5	-174.7	167.9	1.3	112.3	K172 E173 Y174 S202 L205 N206	K172-R176 VanDerWaalsContact O-CG 3.29Å; K172-R176 WeakPolarHBondContact O-CG 3.43Å; K172-R176 PolarHBondContact O-N 2.9Å; E173-R176 PolarHBondContact O-N 2.82Å; Y174-R176 VanDerWaalsContact C-N 3.29Å; Y174-R176 PolarHBondContact O-N 3.13Å; R176-S202 PolarHBondContact NE-OG 3.32Å; R176-L205 HydrophobicContact CB-CD2 4.4Å; R176-L205 HydrophobicContact CG-CD2 4.18Å; R176-N206 WeakPolarHBondContact O-CB 3.34Å; R176-N206 PolarHBondContact O-N 2.96Å
177	K	86.6	Confident	90.8	Very high	54 Å²	54	49.9 Å²	49.9	24%	0.235	23%	0.231	C	C	.	.	H	α-helix	trans	-68.1	-37.1	179	-75.1	175.3	174.9	179.2	0	113	E173 Y174 I175 N206 D364 S366	E173-K177 HydrophobicContact CG-CD 4.32Å; E173-K177 WeakPolarHBondContact O-CG 3.49Å; E173-K177 PolarHBondContact O-N 3.46Å; E173-K177 VanDerWaalsContact OE1-CE 3.23Å; E173-K177 WeakPolarHBondContact OE1-CE 3.39Å; E173-K177 IonicContact OE1-NZ 3.43Å; E173-K177 PolarHBondContact OE1-NZ 3.23Å; Y174-K177 PolarHBondContact O-N 3.09Å; Y174-K177 VanDerWaalsContact O-N 3.15Å; I175-K177 PolarHBondContact O-N 3.06Å; K177-N206 VanDerWaalsContact O-CB 3.32Å; K177-N206 WeakPolarHBondContact O-CB 3.33Å; K177-N206 PolarHBondContact O-ND2 2.96Å; K177-D364 WeakPolarHBondContact CE-OD1 3.32Å; K177-D364 VanDerWaalsContact NZ-CG 3.3Å; K177-D364 IonicContact NZ-OD1 3.97Å; K177-D364 PolarHBondContact NZ-OD1 2.89Å; K177-D364 IonicContact NZ-OD2 3.17Å; K177-D364 PolarHBondContact NZ-OD2 2.79Å; K177-D364 VanDerWaalsContact NZ-OD2 3.12Å; K177-S366 WeakPolarHBondContact CE-OG 3.38Å; K177-S366 PolarHBondContact NZ-OG 2.81Å
178	K	87.9	Confident	90.7	Very high	28 Å²	28	49.9 Å²	49.9	12%	0.122	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	25.8	-175.6	-66.8	-63.2	-176.4	178.6	0	114	Y174 I175 L180 C181 V182 D334 D336	Y174-K178 HydrophobicContact CE1-CB 4.23Å; Y174-K178 HydrophobicContact CE1-CG 4.27Å; Y174-K178 PolarHBondContact O-N 3.34Å; I175-K178 CarbonylContact O-C 3.56Å; I175-K178 PolarHBondContact O-N 3.11Å; K178-L180 VanDerWaalsContact C-N 3.35Å; K178-L180 PolarHBondContact O-N 3.27Å; K178-C181 WeakPolarHBondContact O-CB 3.25Å; K178-C181 PolarHBondContact O-N 3.11Å; K178-V182 HydrophobicContact CB-CG2 4.37Å; K178-V182 WeakPolarHBondContact O-CG2 3.36Å; K178-V182 PolarHBondContact O-N 3.4Å; K178-V182 VanDerWaalsContact O-N 3.11Å; K178-D334 PolarHBondContact NZ-O 3.42Å; K178-D336 WeakPolarHBondContact CE-OD1 3.33Å; K178-D336 WeakPolarHBondContact CE-OD2 3.35Å; K178-D336 IonicContact NZ-OD1 3.45Å; K178-D336 PolarHBondContact NZ-OD1 3.25Å; K178-D336 IonicContact NZ-OD2 2.66Å; K178-D336 PolarHBondContact NZ-OD2 3.19Å
179	F	91.1	Very high	90.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-50.7	-47.6	-170.7	-175	-100.7	0	0	0	113.9	I175 C181 V182 T183 F188 I199 L200 L205 V207	I175-F179 WeakPolarHBondContact O-CA 3.38Å; I175-F179 WeakPolarHBondContact O-CB 3.4Å; I175-F179 PolarHBondContact O-N 3.27Å; F179-C181 PolarHBondContact O-N 3.21Å; F179-V182 PolarHBondContact O-N 2.97Å; F179-V182 VanDerWaalsContact O-N 3.14Å; F179-T183 HydrophobicContact CD1-CG2 3.91Å; F179-T183 HydrophobicContact CD2-CG2 4.16Å; F179-T183 HydrophobicContact CE1-CG2 3.51Å; F179-T183 HydrophobicContact CE2-CG2 3.75Å; F179-T183 HydrophobicContact CG-CG2 4.24Å; F179-T183 HydrophobicContact CZ-CG2 3.42Å; F179-T183 VanDerWaalsContact CZ-CG2 3.42Å; F179-T183 WeakPolarHBondContact O-CG2 3.37Å; F179-T183 PolarHBondContact O-N 2.87Å; F179-T183 PolarHBondContact O-OG1 3.11Å; F179-F188 HydrophobicContact CE2-CE2 4.35Å; F179-I199 HydrophobicContact CE2-CG2 4.4Å; F179-L200 HydrophobicContact CE2-CD2 3.41Å; F179-L200 VanDerWaalsContact CE2-CD2 3.41Å; F179-L200 HydrophobicContact CZ-CD2 3.36Å; F179-L205 HydrophobicContact CB-CD2 4.05Å; F179-L205 HydrophobicContact CD1-CD2 4.45Å; F179-L205 HydrophobicContact CD2-CD2 3.51Å; F179-L205 HydrophobicContact CE2-CD2 4.03Å; F179-L205 HydrophobicContact CG-CD2 3.74Å; F179-V207 HydrophobicContact CB-CG2 4.44Å; F179-V207 HydrophobicContact CD1-CG2 3.3Å; F179-V207 HydrophobicContact CE1-CG2 3.81Å; F179-V207 HydrophobicContact CG-CG2 4.14Å
180	L	88.4	Confident	90.4	Very high	59 Å²	59	52.2 Å²	52.2	31%	0.309	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-24.7	-179.6	-64.8	175.9	0	0	0	114.6	K178 T183 K184 V207 H212	K178-L180 VanDerWaalsContact C-N 3.35Å; K178-L180 PolarHBondContact O-N 3.27Å; L180-T183 PolarHBondContact O-OG1 3.18Å; L180-K184 WeakPolarHBondContact O-CE 3.38Å; L180-V207 HydrophobicContact CD2-CG2 4.49Å; L180-H212 HydrophobicContact CD2-CB 3.89Å
181	C	88	Confident	90.4	Very high	31 Å²	31	47.1 Å²	47.1	21%	0.209	22%	0.218	C	C	.	.	H	α-helix	trans	-83.2	-45.6	174	-61.7	0	0	0	0	110.2	P149 K178 F179 T183 K184	P149-C181 HydrophobicContact CB-CB 4.02Å; P149-C181 HydrophobicContact CG-CB 4.1Å; K178-C181 WeakPolarHBondContact O-CB 3.25Å; K178-C181 PolarHBondContact O-N 3.11Å; F179-C181 PolarHBondContact O-N 3.21Å; C181-T183 PolarHBondContact O-N 3.15Å; C181-K184 WeakPolarHBondContact O-CB 3.42Å; C181-K184 PolarHBondContact O-N 3.01Å
182	V	91.4	Very high	90.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-36.4	-176.5	177.7	0	0	0	0	112.5	P149 I153 I175 K178 F179 K184 E185 F188	P149-V182 HydrophobicContact CB-CG2 4.17Å; I153-V182 HydrophobicContact CD1-CG1 3.54Å; I153-V182 HydrophobicContact CG1-CG1 3.48Å; I153-V182 VanDerWaalsContact CG1-CG1 3.48Å; I175-V182 HydrophobicContact CG2-CG1 4.24Å; K178-V182 HydrophobicContact CB-CG2 4.37Å; K178-V182 WeakPolarHBondContact O-CG2 3.36Å; K178-V182 PolarHBondContact O-N 3.4Å; K178-V182 VanDerWaalsContact O-N 3.11Å; F179-V182 PolarHBondContact O-N 2.97Å; F179-V182 VanDerWaalsContact O-N 3.14Å; V182-K184 PolarHBondContact O-N 3.41Å; V182-K184 VanDerWaalsContact O-N 3.15Å; V182-E185 PolarHBondContact O-N 3.24Å; V182-E185 VanDerWaalsContact O-N 3.11Å; V182-F188 HydrophobicContact CG1-CD2 4.49Å
183	T	89.6	Confident	90	Very high	19 Å²	19	51.7 Å²	51.7	12%	0.117	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.5	178.9	53.6	0	0	0	0	114.1	F179 L180 C181 F188 R219	F179-T183 HydrophobicContact CD1-CG2 3.91Å; F179-T183 HydrophobicContact CD2-CG2 4.16Å; F179-T183 HydrophobicContact CE1-CG2 3.51Å; F179-T183 HydrophobicContact CE2-CG2 3.75Å; F179-T183 HydrophobicContact CG-CG2 4.24Å; F179-T183 HydrophobicContact CZ-CG2 3.42Å; F179-T183 VanDerWaalsContact CZ-CG2 3.42Å; F179-T183 WeakPolarHBondContact O-CG2 3.37Å; F179-T183 PolarHBondContact O-N 2.87Å; F179-T183 PolarHBondContact O-OG1 3.11Å; L180-T183 PolarHBondContact O-OG1 3.18Å; C181-T183 PolarHBondContact O-N 3.15Å; T183-F188 HydrophobicContact CG2-CD2 4.46Å; T183-F188 HydrophobicContact CG2-CE2 4.05Å; T183-F188 HydrophobicContact CG2-CZ 4.08Å; T183-R219 WeakPolarHBondContact O-CD 3.41Å; T183-R219 PolarHBondContact O-NE 3.35Å
184	K	89.4	Confident	90	Very high	145 Å²	145	53.2 Å²	53.2	63%	0.63	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-20.7	177.6	-61.3	177.5	-175.3	172.8	0	112.5	L180 C181 V182 R219	L180-K184 WeakPolarHBondContact O-CE 3.38Å; C181-K184 WeakPolarHBondContact O-CB 3.42Å; C181-K184 PolarHBondContact O-N 3.01Å; V182-K184 PolarHBondContact O-N 3.41Å; V182-K184 VanDerWaalsContact O-N 3.15Å; K184-R219 PolarHBondContact O-NH2 2.92Å
185	E	91.8	Very high	90.1	Very high	56 Å²	56	51.4 Å²	51.4	26%	0.262	25%	0.248	S	C	.	.	S	Bend	trans	-76.8	158.7	-176.1	-61.2	-59.2	155.6	0	0	112.2	Q150 V182	Q150-E185 HydrophobicContact CG-CG 4.42Å; V182-E185 PolarHBondContact O-N 3.24Å; V182-E185 VanDerWaalsContact O-N 3.11Å
186	Q	88.2	Confident	90	Very high	157 Å²	157	51.4 Å²	51.4	73%	0.734	25%	0.248	S	C	*	.	S	Bend	trans	-73.8	-34	-177.4	-68.7	-175.8	6.5	0	0	112.6	F188 L189	Q186-F188 PolarHBondContact O-N 3.03Å; Q186-L189 WeakPolarHBondContact O-CB 3.48Å; Q186-L189 PolarHBondContact O-N 3.33Å
187	E	89.4	Confident	90	Very high	59 Å²	59	49.5 Å²	49.5	28%	0.276	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-61.2	-28.8	-179.1	-63	-168.4	167.3	0	0	112.5	Q150 I153 G154 L189 Q190	Q150-E187 VanDerWaalsContact O-OE2 3.11Å; I153-E187 HydrophobicContact CB-CB 3.81Å; I153-E187 HydrophobicContact CG2-CB 3.95Å; I153-E187 WeakPolarHBondContact CG2-O 3.41Å; G154-E187 WeakPolarHBondContact CA-OE2 3.35Å; G154-E187 PolarHBondContact N-OE2 3.43Å; E187-L189 PolarHBondContact O-N 3.36Å; E187-L189 VanDerWaalsContact O-N 3.13Å; E187-Q190 WeakPolarHBondContact O-CB 3.43Å; E187-Q190 PolarHBondContact O-N 3.01Å
188	F	92.1	Very high	90.3	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-56.1	-31.3	175.4	-175.8	-97.3	0	0	0	112.6	I153 F179 V182 T183 Q186 Q190 L191 L196 W220	I153-F188 HydrophobicContact CD1-CD2 4.42Å; F179-F188 HydrophobicContact CE2-CE2 4.35Å; V182-F188 HydrophobicContact CG1-CD2 4.49Å; T183-F188 HydrophobicContact CG2-CD2 4.46Å; T183-F188 HydrophobicContact CG2-CE2 4.05Å; T183-F188 HydrophobicContact CG2-CZ 4.08Å; Q186-F188 PolarHBondContact O-N 3.03Å; F188-Q190 PolarHBondContact O-N 3.15Å; F188-L191 HydrophobicContact CD2-CD1 3.75Å; F188-L191 HydrophobicContact CE2-CD1 3.87Å; F188-L191 HydrophobicContact CG-CD1 4.39Å; F188-L191 PolarHBondContact O-N 3.13Å; F188-L196 HydrophobicContact CE1-CD1 4.46Å; F188-L196 HydrophobicContact CE2-CD1 4.11Å; F188-L196 HydrophobicContact CZ-CD1 3.72Å; F188-W220 HydrophobicContact CE1-CB 4.15Å
189	L	89.7	Confident	90.4	Very high	23 Å²	23	47.7 Å²	47.7	12%	0.12	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-73	-17	-179.8	-53.3	178.6	0	0	0	113	Q186 E187 R219 H223 R228	Q186-L189 WeakPolarHBondContact O-CB 3.48Å; Q186-L189 PolarHBondContact O-N 3.33Å; E187-L189 PolarHBondContact O-N 3.36Å; E187-L189 VanDerWaalsContact O-N 3.13Å; L189-R219 HydrophobicContact CD2-CG 4Å; L189-R219 WeakPolarHBondContact CD2-O 3.4Å; L189-H223 HydrophobicContact CB-CB 4.33Å; L189-H223 HydrophobicContact CD1-CB 4.36Å; L189-H223 HydrophobicContact CD2-CB 4.42Å; L189-R228 PolarHBondContact O-NH1 3.32Å; L189-R228 PolarHBondContact O-NH2 3.26Å
190	Q	89.8	Confident	90.4	Very high	130 Å²	130	47.7 Å²	47.7	61%	0.607	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-87.4	-6.8	-178.7	-58.8	179.7	-6.3	0	0	113.1	E187 F188 T192	E187-Q190 WeakPolarHBondContact O-CB 3.43Å; E187-Q190 PolarHBondContact O-N 3.01Å; F188-Q190 PolarHBondContact O-N 3.15Å; Q190-T192 PolarHBondContact O-N 2.98Å
191	L	91.5	Very high	90.4	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	25%	0.249	C	C	.	.			trans	-60.9	136.5	179.3	-72.1	172.1	0	0	0	111.6	I153 F156 I157 F188 Q195 L196 I199 W220	I153-L191 HydrophobicContact CD1-CD1 4.19Å; I153-L191 HydrophobicContact CD1-CD2 4.48Å; I153-L191 HydrophobicContact CG2-CD2 3.78Å; I153-L191 HydrophobicContact CG2-CG 4.02Å; F156-L191 HydrophobicContact CD1-CD2 4.17Å; F156-L191 HydrophobicContact CE1-CD2 4.19Å; I157-L191 HydrophobicContact CD1-CD2 4.3Å; I157-L191 HydrophobicContact CG1-CD2 4.26Å; F188-L191 HydrophobicContact CD2-CD1 3.75Å; F188-L191 HydrophobicContact CE2-CD1 3.87Å; F188-L191 HydrophobicContact CG-CD1 4.39Å; F188-L191 PolarHBondContact O-N 3.13Å; L191-Q195 HydrophobicContact CD2-CB 4.14Å; L191-L196 HydrophobicContact CD1-CD1 4Å; L191-I199 HydrophobicContact CD1-CD1 4.08Å; L191-I199 HydrophobicContact CD2-CD1 4.31Å; L191-W220 PolarHBondContact O-NE1 3.01Å
192	T	91.3	Very high	90.4	Very high	71 Å²	71	48.8 Å²	48.8	44%	0.436	25%	0.245	S	C	.	.			trans	-73	162.4	168.6	65.5	0	0	0	0	111	Q190 D194 Q195 L196	Q190-T192 PolarHBondContact O-N 2.98Å; T192-D194 VanDerWaalsContact C-N 3.29Å; T192-D194 PolarHBondContact O-N 3.27Å; T192-Q195 PolarHBondContact O-N 3.11Å; T192-Q195 WeakPolarHBondContact OG1-CB 3.43Å; T192-Q195 VanDerWaalsContact OG1-CG 3.25Å; T192-Q195 WeakPolarHBondContact OG1-CG 3.41Å; T192-Q195 PolarHBondContact OG1-OE1 3.23Å; T192-L196 WeakPolarHBondContact O-CB 3.4Å; T192-L196 PolarHBondContact O-N 3.06Å
193	K	89.4	Confident	90.2	Very high	65 Å²	65	52 Å²	52	28%	0.283	26%	0.263	S	S	.	.	H	α-helix	trans	-54.5	-42.8	179.2	75.7	-177.6	-173.7	173	0	112.8	L196 I197	K193-L196 PolarHBondContact O-N 2.95Å; K193-I197 VanDerWaalsContact O-CG1 3.27Å; K193-I197 WeakPolarHBondContact O-CG1 3.42Å; K193-I197 PolarHBondContact O-N 3.17Å
194	D	90.6	Very high	90	Very high	102 Å²	102	55.5 Å²	55.5	55%	0.545	28%	0.28	S	S	.	.	H	α-helix	trans	-75.5	-37.6	-172.2	-64.1	-44.2	0	0	0	110.4	T192 S198	T192-D194 VanDerWaalsContact C-N 3.29Å; T192-D194 PolarHBondContact O-N 3.27Å; D194-S198 WeakPolarHBondContact O-CB 3.41Å; D194-S198 PolarHBondContact O-N 2.87Å
195	Q	91.8	Very high	89.9	Confident	19 Å²	19	48.6 Å²	48.6	9%	0.089	25%	0.25	C	S	.	.	H	α-helix	trans	-63.9	-43.7	172	-74.1	168.9	-18.2	0	0	111.7	F156 D160 L191 T192 S198 I199	F156-Q195 HydrophobicContact CE1-CB 3.91Å; F156-Q195 HydrophobicContact CE1-CG 4.04Å; F156-Q195 HydrophobicContact CZ-CB 4.29Å; F156-Q195 HydrophobicContact CZ-CG 4.1Å; D160-Q195 PolarHBondContact OD2-NE2 3.28Å; L191-Q195 HydrophobicContact CD2-CB 4.14Å; T192-Q195 PolarHBondContact O-N 3.11Å; T192-Q195 WeakPolarHBondContact OG1-CB 3.43Å; T192-Q195 VanDerWaalsContact OG1-CG 3.25Å; T192-Q195 WeakPolarHBondContact OG1-CG 3.41Å; T192-Q195 PolarHBondContact OG1-OE1 3.23Å; Q195-S198 PolarHBondContact O-N 3.24Å; Q195-I199 WeakPolarHBondContact O-CG1 3.27Å; Q195-I199 PolarHBondContact O-N 2.71Å
196	L	91.8	Very high	89.7	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-48.6	177.2	-174.8	68.9	0	0	0	111.3	F188 L191 T192 K193 S198 I199 L200 W220 I235	F188-L196 HydrophobicContact CE1-CD1 4.46Å; F188-L196 HydrophobicContact CE2-CD1 4.11Å; F188-L196 HydrophobicContact CZ-CD1 3.72Å; L191-L196 HydrophobicContact CD1-CD1 4Å; T192-L196 WeakPolarHBondContact O-CB 3.4Å; T192-L196 PolarHBondContact O-N 3.06Å; K193-L196 PolarHBondContact O-N 2.95Å; L196-S198 VanDerWaalsContact C-N 3.32Å; L196-S198 PolarHBondContact O-N 2.94Å; L196-I199 PolarHBondContact O-N 2.8Å; L196-I199 VanDerWaalsContact O-N 3.1Å; L196-L200 HydrophobicContact CD1-CD1 3.8Å; L196-L200 HydrophobicContact CD1-CG 4.07Å; L196-L200 HydrophobicContact CD2-CD1 4.27Å; L196-L200 HydrophobicContact CG-CD1 3.75Å; L196-L200 HydrophobicContact CG-CG 4.22Å; L196-L200 WeakPolarHBondContact O-CG 3.2Å; L196-L200 PolarHBondContact O-N 2.83Å; L196-W220 HydrophobicContact CD2-CD2 3.7Å; L196-W220 HydrophobicContact CD2-CE3 3.92Å; L196-W220 HydrophobicContact CD2-CG 4.03Å; L196-W220 HydrophobicContact CD2-CZ2 4.4Å; L196-W220 HydrophobicContact CD2-CZ3 4.35Å; L196-I235 HydrophobicContact CD2-CD1 4.31Å; L196-I235 HydrophobicContact CD2-CG2 4.38Å
197	I	91.1	Very high	89.6	Confident	21 Å²	21	40.5 Å²	40.5	11%	0.108	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-42.5	177.5	-66.4	168.7	0	0	0	110.6	K193 I199 L200 D201 I235 K238	K193-I197 VanDerWaalsContact O-CG1 3.27Å; K193-I197 WeakPolarHBondContact O-CG1 3.42Å; K193-I197 PolarHBondContact O-N 3.17Å; I197-I199 PolarHBondContact O-N 3.2Å; I197-I199 VanDerWaalsContact O-N 3.14Å; I197-L200 PolarHBondContact O-N 3.13Å; I197-D201 VanDerWaalsContact O-CB 3.25Å; I197-D201 WeakPolarHBondContact O-CB 3.22Å; I197-D201 PolarHBondContact O-N 3.37Å; I197-I235 HydrophobicContact CD1-CG1 4.09Å; I197-I235 HydrophobicContact CG1-CG1 4.1Å; I197-K238 HydrophobicContact CD1-CD 4.34Å; I197-K238 HydrophobicContact CG2-CB 4.48Å; I197-K238 HydrophobicContact CG2-CD 4.13Å
198	S	91.1	Very high	89.4	Confident	43 Å²	43	41.2 Å²	41.2	30%	0.301	22%	0.22	S	C	.	.	H	α-helix	trans	-59.3	-25.5	177.2	176.8	0	0	0	0	113.8	K172 D194 Q195 L196	K172-S198 PolarHBondContact NZ-OG 3.21Å; D194-S198 WeakPolarHBondContact O-CB 3.41Å; D194-S198 PolarHBondContact O-N 2.87Å; Q195-S198 PolarHBondContact O-N 3.24Å; L196-S198 VanDerWaalsContact C-N 3.32Å; L196-S198 PolarHBondContact O-N 2.94Å
199	I	91.3	Very high	89.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-87.9	-48.7	177.1	-64.9	165	0	0	0	110	F156 I175 F179 L191 Q195 L196 I197 L205	F156-I199 HydrophobicContact CD1-CD1 4.04Å; F156-I199 HydrophobicContact CE1-CD1 3.79Å; F156-I199 HydrophobicContact CE1-CG1 4.35Å; I175-I199 HydrophobicContact CD1-CD1 4.35Å; I175-I199 HydrophobicContact CG2-CD1 4.34Å; I175-I199 HydrophobicContact CG2-CG2 3.81Å; F179-I199 HydrophobicContact CE2-CG2 4.4Å; L191-I199 HydrophobicContact CD1-CD1 4.08Å; L191-I199 HydrophobicContact CD2-CD1 4.31Å; Q195-I199 WeakPolarHBondContact O-CG1 3.27Å; Q195-I199 PolarHBondContact O-N 2.71Å; L196-I199 PolarHBondContact O-N 2.8Å; L196-I199 VanDerWaalsContact O-N 3.1Å; I197-I199 PolarHBondContact O-N 3.2Å; I197-I199 VanDerWaalsContact O-N 3.14Å; I199-L205 HydrophobicContact CG2-CD2 4.5Å
200	L	90.6	Very high	89.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-77.5	-24.7	-169.6	-62.7	-174.1	0	0	0	115.4	F179 L196 I197 S202 L205 V213 I217 C239 R279	F179-L200 HydrophobicContact CE2-CD2 3.41Å; F179-L200 VanDerWaalsContact CE2-CD2 3.41Å; F179-L200 HydrophobicContact CZ-CD2 3.36Å; L196-L200 HydrophobicContact CD1-CD1 3.8Å; L196-L200 HydrophobicContact CD1-CG 4.07Å; L196-L200 HydrophobicContact CD2-CD1 4.27Å; L196-L200 HydrophobicContact CG-CD1 3.75Å; L196-L200 HydrophobicContact CG-CG 4.22Å; L196-L200 WeakPolarHBondContact O-CG 3.2Å; L196-L200 PolarHBondContact O-N 2.83Å; I197-L200 PolarHBondContact O-N 3.13Å; L200-S202 PolarHBondContact O-N 2.95Å; L200-L205 HydrophobicContact CD2-CD1 4.42Å; L200-L205 WeakPolarHBondContact O-CD1 3.3Å; L200-V213 HydrophobicContact CD1-CG1 4.44Å; L200-V213 HydrophobicContact CD2-CG1 4.3Å; L200-I217 HydrophobicContact CD1-CD1 3.81Å; L200-I217 HydrophobicContact CD1-CG1 3.5Å; L200-C239 HydrophobicContact CB-CB 3.77Å; L200-C239 HydrophobicContact CD1-CB 4.21Å; L200-R279 PolarHBondContact O-NH1 3.22Å
201	D	89.4	Confident	89	Confident	96 Å²	96	38.8 Å²	38.8	51%	0.513	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.8	178.1	-172.5	52.6	0	0	0	112.5	I197 R241	I197-D201 VanDerWaalsContact O-CB 3.25Å; I197-D201 WeakPolarHBondContact O-CB 3.22Å; I197-D201 PolarHBondContact O-N 3.37Å; D201-R241 PolarHBondContact O-NH2 2.89Å
202	S	88	Confident	88.9	Confident	17 Å²	17	41.5 Å²	41.5	12%	0.119	22%	0.216	C	C	.	.			trans	-67.8	135.2	-173.7	-173.4	0	0	0	0	114.3	R176 L200 D204 R279	R176-S202 PolarHBondContact NE-OG 3.32Å; L200-S202 PolarHBondContact O-N 2.95Å; S202-D204 VanDerWaalsContact C-N 3.26Å; S202-D204 PolarHBondContact O-N 2.8Å; S202-D204 PolarHBondContact OG-N 3.05Å; S202-R279 PolarHBondContact O-NH1 2.8Å
203	D	86.4	Confident	88.9	Confident	69 Å²	69	38.1 Å²	38.1	37%	0.369	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-25.8	169.8	-76.6	-15.6	0	0	0	112.9	L205 R241 T277 R279 L280	D203-L205 PolarHBondContact O-N 3.13Å; D203-R241 IonicContact OD1-CZ 3.42Å; D203-R241 IonicContact OD1-NH1 3.65Å; D203-R241 PolarHBondContact OD1-NH1 3.41Å; D203-R241 IonicContact OD1-NH2 3.66Å; D203-R241 PolarHBondContact OD1-NH2 2.81Å; D203-T277 PolarHBondContact OD1-OG1 2.75Å; D203-T277 PolarHBondContact OD2-OG1 2.82Å; D203-R279 CarbonylContact O-C 3.46Å; D203-R279 WeakPolarHBondContact O-CA 3.48Å; D203-L280 PolarHBondContact O-N 3.47Å
204	D	84.6	Confident	88.9	Confident	92 Å²	92	36 Å²	36	49%	0.492	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	9.5	-173.6	-60.6	-45.9	0	0	0	113.8	S202 N206	S202-D204 VanDerWaalsContact C-N 3.26Å; S202-D204 PolarHBondContact O-N 2.8Å; S202-D204 PolarHBondContact OG-N 3.05Å; D204-N206 PolarHBondContact O-N 2.76Å
205	L	88.4	Confident	88.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.			trans	-64.9	127	177.5	-84.3	169.6	0	0	0	111.4	R176 F179 I199 L200 D203 V207 G281	R176-L205 HydrophobicContact CB-CD2 4.4Å; R176-L205 HydrophobicContact CG-CD2 4.18Å; F179-L205 HydrophobicContact CB-CD2 4.05Å; F179-L205 HydrophobicContact CD1-CD2 4.45Å; F179-L205 HydrophobicContact CD2-CD2 3.51Å; F179-L205 HydrophobicContact CE2-CD2 4.03Å; F179-L205 HydrophobicContact CG-CD2 3.74Å; I199-L205 HydrophobicContact CG2-CD2 4.5Å; L200-L205 HydrophobicContact CD2-CD1 4.42Å; L200-L205 WeakPolarHBondContact O-CD1 3.3Å; D203-L205 PolarHBondContact O-N 3.13Å; L205-V207 VanDerWaalsContact C-N 3.29Å; L205-V207 HydrophobicContact CB-CG2 4.41Å; L205-V207 PolarHBondContact O-N 3.45Å; L205-G281 PolarHBondContact O-N 2.94Å
206	N	87.1	Confident	88.8	Confident	42 Å²	42	35 Å²	35	23%	0.225	18%	0.178	C	C	.	.			trans	-81.8	77.4	176	-175.7	13.3	0	0	0	110.9	R176 K177 D204 Y593	R176-N206 WeakPolarHBondContact O-CB 3.34Å; R176-N206 PolarHBondContact O-N 2.96Å; K177-N206 VanDerWaalsContact O-CB 3.32Å; K177-N206 WeakPolarHBondContact O-CB 3.33Å; K177-N206 PolarHBondContact O-ND2 2.96Å; D204-N206 PolarHBondContact O-N 2.76Å; N206-Y593 PolarHBondContact ND2-OH 3.2Å; N206-Y593 PolarHBondContact OD1-OH 3.2Å
207	V	86.8	Confident	88.7	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.			trans	-131.4	127	178.6	175.7	0	0	0	0	109.3	F179 L180 L205 R209 H212 V213 G281 M282	F179-V207 HydrophobicContact CB-CG2 4.44Å; F179-V207 HydrophobicContact CD1-CG2 3.3Å; F179-V207 HydrophobicContact CE1-CG2 3.81Å; F179-V207 HydrophobicContact CG-CG2 4.14Å; L180-V207 HydrophobicContact CD2-CG2 4.49Å; L205-V207 VanDerWaalsContact C-N 3.29Å; L205-V207 HydrophobicContact CB-CG2 4.41Å; L205-V207 PolarHBondContact O-N 3.45Å; V207-R209 WeakPolarHBondContact CG1-O 3.23Å; V207-H212 HydrophobicContact CG1-CB 3.89Å; V207-V213 HydrophobicContact CG1-CG2 4.22Å; V207-V213 HydrophobicContact CG2-CG2 4.23Å; V207-G281 CarbonylContact O-C 3.56Å; V207-G281 WeakPolarHBondContact O-CA 3.29Å; V207-M282 WeakPolarHBondContact O-CG 3.42Å; V207-M282 PolarHBondContact O-N 3.32Å
208	D	83.7	Confident	88.5	Confident	75 Å²	75	35.2 Å²	35.2	40%	0.401	18%	0.179	S	C	.	.	S	Bend	trans	-77.2	-22.5	178.1	57.7	-21.3	0	0	0	113.1	H212	D208-H212 IonicContact OD1-CD2 2.9Å; D208-H212 PolarHBondContact OD1-CD2 3.18Å; D208-H212 IonicContact OD1-NE2 2.71Å; D208-H212 PolarHBondContact OD1-NE2 2.94Å
209	R	86.8	Confident	88.5	Confident	93 Å²	93	38.2 Å²	38.2	35%	0.351	18%	0.184	S	C	.	.			trans	-144.7	126.2	-170	-77.3	-159.7	74.8	132.2	3.6	112	V207 E211 H212 E246	V207-R209 WeakPolarHBondContact CG1-O 3.23Å; R209-E211 WeakPolarHBondContact CB-OE2 3.48Å; R209-E211 IonicContact CZ-OE1 3.72Å; R209-E211 IonicContact CZ-OE2 3Å; R209-E211 IonicContact NE-OE1 2.95Å; R209-E211 IonicContact NE-OE2 3.77Å; R209-E211 PolarHBondContact NE-OE2 3.1Å; R209-E211 VanDerWaalsContact NH2-CD 3.35Å; R209-E211 IonicContact NH2-OE1 2.87Å; R209-E211 PolarHBondContact NH2-OE1 2.93Å; R209-E211 IonicContact NH2-OE2 2.67Å; R209-E211 PolarHBondContact O-N 3.42Å; R209-E211 VanDerWaalsContact O-N 3.07Å; R209-H212 PolarHBondContact O-N 3.29Å; R209-E246 IonicContact CZ-OE1 3.09Å; R209-E246 VanDerWaalsContact CZ-OE1 3.3Å; R209-E246 IonicContact NH1-OE1 2.76Å; R209-E246 PolarHBondContact NH1-OE1 2.85Å; R209-E246 VanDerWaalsContact NH1-OE1 3.07Å; R209-E246 IonicContact NH2-OE1 3.38Å; R209-E246 PolarHBondContact NH2-OE1 3.37Å; R209-E246 IonicContact NH2-OE2 3.4Å
210	E	88.8	Confident	88.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-23.8	-177.8	-166.7	67.8	-171	0	0	111.5	H212 V213 Y214 I240 R241 L244 M245 R279 M282	E210-H212 PolarHBondContact O-N 2.93Å; E210-V213 WeakPolarHBondContact O-CB 3.48Å; E210-V213 PolarHBondContact O-N 3.01Å; E210-Y214 PolarHBondContact O-N 2.86Å; E210-I240 HydrophobicContact CG-CG2 4.43Å; E210-R241 HydrophobicContact CG-CB 4.17Å; E210-R241 PolarHBondContact OE1-N 2.94Å; E210-L244 HydrophobicContact CB-CB 4.3Å; E210-M245 HydrophobicContact CB-CG 3.73Å; E210-M245 HydrophobicContact CG-CG 3.88Å; E210-M245 HydrophobicContact CG-SD 4.45Å; E210-R279 IonicContact OE1-CZ 3.01Å; E210-R279 IonicContact OE1-NE 2.65Å; E210-R279 PolarHBondContact OE1-NE 2.87Å; E210-R279 IonicContact OE1-NH2 2.64Å; E210-R279 PolarHBondContact OE1-NH2 2.72Å; E210-R279 WeakPolarHBondContact OE2-CD 3.47Å; E210-R279 IonicContact OE2-CZ 3.49Å; E210-R279 IonicContact OE2-NE 3.24Å; E210-R279 PolarHBondContact OE2-NE 2.8Å; E210-R279 IonicContact OE2-NH2 3.26Å; E210-M282 HydrophobicContact CB-CE 3.7Å
211	E	88.6	Confident	88.3	Confident	9 Å²	9	39.5 Å²	39.5	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-54.9	-34.9	173.4	-60.7	88	168.7	0	0	112.4	R209 V213 Y214 E215 M245 E246 F249	R209-E211 WeakPolarHBondContact CB-OE2 3.48Å; R209-E211 IonicContact CZ-OE1 3.72Å; R209-E211 IonicContact CZ-OE2 3Å; R209-E211 IonicContact NE-OE1 2.95Å; R209-E211 IonicContact NE-OE2 3.77Å; R209-E211 PolarHBondContact NE-OE2 3.1Å; R209-E211 VanDerWaalsContact NH2-CD 3.35Å; R209-E211 IonicContact NH2-OE1 2.87Å; R209-E211 PolarHBondContact NH2-OE1 2.93Å; R209-E211 IonicContact NH2-OE2 2.67Å; R209-E211 PolarHBondContact O-N 3.42Å; R209-E211 VanDerWaalsContact O-N 3.07Å; E211-V213 VanDerWaalsContact C-N 3.32Å; E211-V213 PolarHBondContact O-N 3.2Å; E211-Y214 WeakPolarHBondContact O-CB 3.45Å; E211-Y214 PolarHBondContact O-N 2.94Å; E211-E215 WeakPolarHBondContact O-CB 3.39Å; E211-E215 VanDerWaalsContact O-CG 3.28Å; E211-E215 WeakPolarHBondContact O-CG 3.26Å; E211-E215 PolarHBondContact O-N 3.19Å; E211-M245 HydrophobicContact CG-CE 4.25Å; E211-E246 PolarHBondContact OE1-N 3.09Å; E211-E246 VanDerWaalsContact OE1-N 3.11Å; E211-F249 HydrophobicContact CB-CE2 4.26Å; E211-F249 HydrophobicContact CB-CZ 4.32Å; E211-F249 HydrophobicContact CG-CB 4.42Å; E211-F249 HydrophobicContact CG-CD1 4.18Å; E211-F249 HydrophobicContact CG-CD2 3.9Å; E211-F249 HydrophobicContact CG-CE1 4.38Å; E211-F249 HydrophobicContact CG-CE2 4.14Å; E211-F249 HydrophobicContact CG-CG 3.9Å; E211-F249 HydrophobicContact CG-CZ 4.36Å
212	H	89.8	Confident	88.2	Confident	57 Å²	57	40.7 Å²	40.7	26%	0.264	19%	0.192	S	C	.	.	H	α-helix	trans	-69.3	-29	177.3	-66.6	-42.5	0	0	0	113.2	L180 V207 D208 R209 E210 E215 S216	L180-H212 HydrophobicContact CD2-CB 3.89Å; V207-H212 HydrophobicContact CG1-CB 3.89Å; D208-H212 IonicContact OD1-CD2 2.9Å; D208-H212 PolarHBondContact OD1-CD2 3.18Å; D208-H212 IonicContact OD1-NE2 2.71Å; D208-H212 PolarHBondContact OD1-NE2 2.94Å; R209-H212 PolarHBondContact O-N 3.29Å; E210-H212 PolarHBondContact O-N 2.93Å; H212-E215 IonicContact CE1-OE2 2.81Å; H212-E215 IonicContact ND1-OE2 3.57Å; H212-E215 PolarHBondContact ND1-OE2 3.24Å; H212-S216 WeakPolarHBondContact O-CB 3.25Å; H212-S216 PolarHBondContact O-N 3.05Å
213	V	90.7	Very high	88.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.5	-45.2	172	-179.9	0	0	0	0	109.3	L200 V207 E210 E211 S216 I217	L200-V213 HydrophobicContact CD1-CG1 4.44Å; L200-V213 HydrophobicContact CD2-CG1 4.3Å; V207-V213 HydrophobicContact CG1-CG2 4.22Å; V207-V213 HydrophobicContact CG2-CG2 4.23Å; E210-V213 WeakPolarHBondContact O-CB 3.48Å; E210-V213 PolarHBondContact O-N 3.01Å; E211-V213 VanDerWaalsContact C-N 3.32Å; E211-V213 PolarHBondContact O-N 3.2Å; V213-S216 PolarHBondContact O-N 3.37Å; V213-S216 PolarHBondContact O-OG 2.87Å; V213-I217 HydrophobicContact CG1-CD1 4.14Å; V213-I217 WeakPolarHBondContact O-CG1 3.43Å; V213-I217 PolarHBondContact O-N 2.9Å; V213-I217 VanDerWaalsContact O-N 3.15Å
214	Y	88.9	Confident	88.1	Confident	22 Å²	22	45.5 Å²	45.5	9%	0.086	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-49.7	174.4	172.9	-87.2	0	0	0	112	E210 E211 S216 I217 I218 F236 I240 M245 F249 I253	E210-Y214 PolarHBondContact O-N 2.86Å; E211-Y214 WeakPolarHBondContact O-CB 3.45Å; E211-Y214 PolarHBondContact O-N 2.94Å; Y214-S216 VanDerWaalsContact C-N 3.26Å; Y214-S216 PolarHBondContact O-N 2.89Å; Y214-I217 PolarHBondContact O-N 3.33Å; Y214-I217 VanDerWaalsContact O-N 3.13Å; Y214-I218 HydrophobicContact CD1-CG1 4.23Å; Y214-I218 HydrophobicContact CE1-CG1 3.69Å; Y214-I218 HydrophobicContact CE2-CG1 4.18Å; Y214-I218 PolarHBondContact O-N 3.45Å; Y214-F236 AromaticContact CD2-CE1 3.9Å; Y214-F236 HydrophobicContact CD2-CE1 3.9Å; Y214-F236 HydrophobicContact CD2-CZ 4.04Å; Y214-F236 AromaticContact CE2-CE1 3.64Å; Y214-F236 HydrophobicContact CE2-CE1 3.64Å; Y214-F236 AromaticContact CE2-CZ 3.8Å; Y214-F236 HydrophobicContact CE2-CZ 3.8Å; Y214-I240 HydrophobicContact CD2-CD1 3.99Å; Y214-M245 HydrophobicContact CG-CE 4.47Å; Y214-F249 AromaticContact CD1-CE1 3.62Å; Y214-F249 HydrophobicContact CD1-CE1 3.62Å; Y214-F249 AromaticContact CD1-CZ 3.66Å; Y214-F249 HydrophobicContact CD1-CZ 3.66Å; Y214-F249 AromaticContact CE1-CE1 3.85Å; Y214-F249 HydrophobicContact CE1-CE1 3.85Å; Y214-F249 AromaticContact CE1-CZ 3.91Å; Y214-F249 HydrophobicContact CE1-CZ 3.91Å; Y214-F249 HydrophobicContact CG-CE1 4.11Å; Y214-F249 HydrophobicContact CG-CZ 4.5Å; Y214-I253 HydrophobicContact CE2-CD1 4.21Å; Y214-I253 HydrophobicContact CE2-CG1 4.23Å; Y214-I253 HydrophobicContact CE2-CG2 4.24Å
215	E	89.1	Confident	88	Confident	94 Å²	94	46 Å²	46	44%	0.439	21%	0.21	S	C	.	.	H	α-helix	trans	-60.8	-33.7	178.5	-72.8	170.2	170.1	0	0	112.5	E211 H212 I218 R219	E211-E215 WeakPolarHBondContact O-CB 3.39Å; E211-E215 VanDerWaalsContact O-CG 3.28Å; E211-E215 WeakPolarHBondContact O-CG 3.26Å; E211-E215 PolarHBondContact O-N 3.19Å; H212-E215 IonicContact CE1-OE2 2.81Å; H212-E215 IonicContact ND1-OE2 3.57Å; H212-E215 PolarHBondContact ND1-OE2 3.24Å; E215-I218 WeakPolarHBondContact O-CA 3.47Å; E215-R219 PolarHBondContact O-N 3.2Å
216	S	91.1	Very high	87.5	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.028	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-39.9	175.2	75.6	0	0	0	0	112.3	H212 V213 Y214 R219 W220	H212-S216 WeakPolarHBondContact O-CB 3.25Å; H212-S216 PolarHBondContact O-N 3.05Å; V213-S216 PolarHBondContact O-N 3.37Å; V213-S216 PolarHBondContact O-OG 2.87Å; Y214-S216 VanDerWaalsContact C-N 3.26Å; Y214-S216 PolarHBondContact O-N 2.89Å; S216-R219 PolarHBondContact O-N 3.31Å; S216-W220 PolarHBondContact O-N 2.92Å
217	I	89.8	Confident	87.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-71.1	-49.5	178.4	-61.4	160.5	0	0	0	110.2	L200 V213 Y214 W220 F221 L232 I235 F236 C239 I240	L200-I217 HydrophobicContact CD1-CD1 3.81Å; L200-I217 HydrophobicContact CD1-CG1 3.5Å; V213-I217 HydrophobicContact CG1-CD1 4.14Å; V213-I217 WeakPolarHBondContact O-CG1 3.43Å; V213-I217 PolarHBondContact O-N 2.9Å; V213-I217 VanDerWaalsContact O-N 3.15Å; Y214-I217 PolarHBondContact O-N 3.33Å; Y214-I217 VanDerWaalsContact O-N 3.13Å; I217-W220 PolarHBondContact O-N 2.92Å; I217-F221 WeakPolarHBondContact O-CB 3.07Å; I217-F221 PolarHBondContact O-N 3.22Å; I217-L232 HydrophobicContact CG2-CD2 4Å; I217-I235 HydrophobicContact CD1-CG2 4.01Å; I217-I235 HydrophobicContact CG1-CG2 4.19Å; I217-I235 HydrophobicContact CG2-CG2 3.9Å; I217-F236 HydrophobicContact CB-CE2 4.39Å; I217-F236 HydrophobicContact CG2-CD2 4.13Å; I217-F236 HydrophobicContact CG2-CE2 3.55Å; I217-F236 HydrophobicContact CG2-CZ 4.48Å; I217-C239 HydrophobicContact CD1-CB 4.19Å; I217-I240 HydrophobicContact CD1-CD1 3.73Å; I217-I240 HydrophobicContact CD1-CG1 3.63Å
218	I	88.2	Confident	87	Confident	26 Å²	26	58.7 Å²	58.7	13%	0.133	27%	0.272	C	S	.	.	H	α-helix	trans	0.4	-92.5	138.8	-9.5	-74.4	0	0	0	117.1	Y214 E215 W220 F221 E222 F236	Y214-I218 HydrophobicContact CD1-CG1 4.23Å; Y214-I218 HydrophobicContact CE1-CG1 3.69Å; Y214-I218 HydrophobicContact CE2-CG1 4.18Å; Y214-I218 PolarHBondContact O-N 3.45Å; E215-I218 WeakPolarHBondContact O-CA 3.47Å; I218-W220 VanDerWaalsContact C-N 3.31Å; I218-W220 PolarHBondContact O-N 2.75Å; I218-F221 WeakPolarHBondContact O-CB 3.37Å; I218-F221 PolarHBondContact O-N 2.97Å; I218-F221 VanDerWaalsContact O-N 3.09Å; I218-E222 HydrophobicContact CG2-CG 3.95Å; I218-E222 PolarHBondContact O-N 3.45Å; I218-F236 HydrophobicContact CD1-CE2 4.46Å; I218-F236 HydrophobicContact CD1-CZ 3.94Å
219	R	89.8	Confident	86.8	Confident	106 Å²	106	61 Å²	61	40%	0.4	28%	0.28	S	S	.	.	H	α-helix	trans	-57.2	-39.3	-178	-169.6	-168.6	170.9	93.5	-4.4	113	T183 K184 L189 E215 S216	T183-R219 WeakPolarHBondContact O-CD 3.41Å; T183-R219 PolarHBondContact O-NE 3.35Å; K184-R219 PolarHBondContact O-NH2 2.92Å; L189-R219 HydrophobicContact CD2-CG 4Å; L189-R219 WeakPolarHBondContact CD2-O 3.4Å; E215-R219 PolarHBondContact O-N 3.2Å; S216-R219 PolarHBondContact O-N 3.31Å
220	W	91.5	Very high	86.6	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.015	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-41.5	175.7	177	89	0	0	0	111.4	F188 L191 L196 S216 I217 I218 R228 I235	F188-W220 HydrophobicContact CE1-CB 4.15Å; L191-W220 PolarHBondContact O-NE1 3.01Å; L196-W220 HydrophobicContact CD2-CD2 3.7Å; L196-W220 HydrophobicContact CD2-CE3 3.92Å; L196-W220 HydrophobicContact CD2-CG 4.03Å; L196-W220 HydrophobicContact CD2-CZ2 4.4Å; L196-W220 HydrophobicContact CD2-CZ3 4.35Å; S216-W220 PolarHBondContact O-N 2.92Å; I217-W220 PolarHBondContact O-N 2.92Å; I218-W220 VanDerWaalsContact C-N 3.31Å; I218-W220 PolarHBondContact O-N 2.75Å; W220-R228 HydrophobicContact CH2-CB 3.95Å; W220-R228 HydrophobicContact CH2-CG 3.64Å; W220-R228 HydrophobicContact CZ2-CG 4.03Å; W220-R228 HydrophobicContact CZ3-CB 3.82Å; W220-R228 HydrophobicContact CZ3-CG 3.94Å; W220-R228 VanDerWaalsContact NE1-NH1 3.15Å; W220-R228 WeakPolarHBondContact O-CD 3.46Å; W220-R228 PolarHBondContact O-NH1 3.42Å; W220-I235 HydrophobicContact CE3-CD1 4.33Å; W220-I235 HydrophobicContact CH2-CD1 3.71Å; W220-I235 HydrophobicContact CZ3-CD1 3.45Å; W220-I235 VanDerWaalsContact CZ3-CD1 3.45Å
221	F	87.3	Confident	86.2	Confident	24 Å²	24	65 Å²	65	11%	0.105	31%	0.31	C	S	.	.	H	α-helix	trans	-68.2	-42.2	177.9	169.7	-108.1	0	0	0	112.9	I217 I218 H223 E224 Q225 R228 E229 L232	I217-F221 WeakPolarHBondContact O-CB 3.07Å; I217-F221 PolarHBondContact O-N 3.22Å; I218-F221 WeakPolarHBondContact O-CB 3.37Å; I218-F221 PolarHBondContact O-N 2.97Å; I218-F221 VanDerWaalsContact O-N 3.09Å; F221-H223 PolarHBondContact O-N 3.02Å; F221-H223 VanDerWaalsContact O-N 3.11Å; F221-E224 CarbonylContact O-C 3.46Å; F221-E224 PolarHBondContact O-N 2.98Å; F221-Q225 HydrophobicContact CD1-CG 4.44Å; F221-Q225 HydrophobicContact CE1-CB 4.48Å; F221-Q225 HydrophobicContact CE1-CG 4Å; F221-Q225 HydrophobicContact CE2-CB 4.27Å; F221-Q225 HydrophobicContact CE2-CG 4.5Å; F221-Q225 WeakPolarHBondContact CE2-O 3.49Å; F221-Q225 HydrophobicContact CZ-CB 4.01Å; F221-Q225 HydrophobicContact CZ-CG 4.04Å; F221-Q225 PolarHBondContact O-N 3.39Å; F221-R228 HydrophobicContact CD2-CB 3.89Å; F221-R228 HydrophobicContact CE2-CB 4.48Å; F221-E229 HydrophobicContact CE2-CB 3.97Å; F221-E229 HydrophobicContact CZ-CB 4.47Å; F221-L232 HydrophobicContact CB-CD1 4.37Å; F221-L232 HydrophobicContact CB-CD2 3.95Å; F221-L232 HydrophobicContact CB-CG 4.5Å; F221-L232 HydrophobicContact CD1-CD1 3.99Å; F221-L232 HydrophobicContact CD2-CD1 3.37Å; F221-L232 HydrophobicContact CD2-CD2 4.04Å; F221-L232 HydrophobicContact CD2-CG 3.66Å; F221-L232 HydrophobicContact CE1-CD1 4.08Å; F221-L232 HydrophobicContact CE2-CD1 3.48Å; F221-L232 VanDerWaalsContact CE2-CD1 3.48Å; F221-L232 HydrophobicContact CE2-CG 4.08Å; F221-L232 HydrophobicContact CG-CD1 3.63Å; F221-L232 HydrophobicContact CG-CD2 4.1Å; F221-L232 HydrophobicContact CG-CG 4.12Å; F221-L232 HydrophobicContact CZ-CD1 3.84Å
222	E	87.1	Confident	85.8	Confident	120 Å²	120	64.7 Å²	64.7	56%	0.561	31%	0.309	S	S	*	.	H	α-helix	trans	-59.7	-24.2	-178.6	-74	180	165.3	0	0	113.7	I218	I218-E222 HydrophobicContact CG2-CG 3.95Å; I218-E222 PolarHBondContact O-N 3.45Å
223	H	87.6	Confident	85.3	Confident	106 Å²	106	65.6 Å²	65.6	49%	0.491	32%	0.32	S	S	.	.	H	α-helix	trans	-68.2	-40.7	178	-169.4	62.2	0	0	0	113.4	L189 F221	L189-H223 HydrophobicContact CB-CB 4.33Å; L189-H223 HydrophobicContact CD1-CB 4.36Å; L189-H223 HydrophobicContact CD2-CB 4.42Å; F221-H223 PolarHBondContact O-N 3.02Å; F221-H223 VanDerWaalsContact O-N 3.11Å
224	E	85.1	Confident	84.9	Confident	82 Å²	82	69.4 Å²	69.4	38%	0.383	34%	0.338	S	S	.	.	S	Bend	trans	-139.6	68.8	-178.8	-64.4	174.9	162.7	0	0	110.9	F221 N226 E227 R228	F221-E224 CarbonylContact O-C 3.46Å; F221-E224 PolarHBondContact O-N 2.98Å; E224-N226 VanDerWaalsContact C-N 3.28Å; E224-N226 PolarHBondContact O-N 2.85Å; E224-E227 PolarHBondContact O-N 2.96Å; E224-R228 HydrophobicContact CB-CG 4.14Å; E224-R228 VanDerWaalsContact CD-NH2 3.31Å; E224-R228 VanDerWaalsContact O-CB 3.3Å; E224-R228 WeakPolarHBondContact O-CB 3.31Å; E224-R228 WeakPolarHBondContact O-CG 3.49Å; E224-R228 PolarHBondContact O-N 3.18Å; E224-R228 VanDerWaalsContact O-N 3.14Å; E224-R228 IonicContact OE1-NH2 3.11Å; E224-R228 IonicContact OE2-CZ 2.57Å; E224-R228 IonicContact OE2-NE 2.71Å; E224-R228 PolarHBondContact OE2-NE 3.38Å; E224-R228 IonicContact OE2-NH2 2.72Å; E224-R228 PolarHBondContact OE2-NH2 3.18Å
225	Q	81	Confident	84.6	Confident	102 Å²	102	68.4 Å²	68.4	48%	0.477	33%	0.334	S	S	.	.	H	α-helix	trans	-56.4	-40.6	-174.3	-66.2	-178.7	-14.8	0	0	113	F221 E227 E229	F221-Q225 HydrophobicContact CD1-CG 4.44Å; F221-Q225 HydrophobicContact CE1-CB 4.48Å; F221-Q225 HydrophobicContact CE1-CG 4Å; F221-Q225 HydrophobicContact CE2-CB 4.27Å; F221-Q225 HydrophobicContact CE2-CG 4.5Å; F221-Q225 WeakPolarHBondContact CE2-O 3.49Å; F221-Q225 HydrophobicContact CZ-CB 4.01Å; F221-Q225 HydrophobicContact CZ-CG 4.04Å; F221-Q225 PolarHBondContact O-N 3.39Å; Q225-E227 PolarHBondContact O-N 3.45Å; Q225-E229 WeakPolarHBondContact O-CB 3.23Å; Q225-E229 PolarHBondContact O-N 2.94Å
226	N	78.9	Confident	84.3	Confident	150 Å²	150	64 Å²	64	80%	0.802	31%	0.313	S	S	*	.	H	α-helix	trans	-67.7	-36.4	-172.3	-63.5	-26.7	0	0	0	113.9	E224	E224-N226 VanDerWaalsContact C-N 3.28Å; E224-N226 PolarHBondContact O-N 2.85Å
227	E	81.6	Confident	83.7	Confident	142 Å²	142	66.5 Å²	66.5	66%	0.664	33%	0.334	S	S	*	.	H	α-helix	trans	-91.1	-31.9	-178.7	-63.8	-167.6	173.8	0	0	111.8	E224 Q225	E224-E227 PolarHBondContact O-N 2.96Å; Q225-E227 PolarHBondContact O-N 3.45Å
228	R	82.8	Confident	83.4	Confident	16 Å²	16	71.6 Å²	71.6	6%	0.06	36%	0.356	C	S	.	.	H	α-helix	trans	-86.9	-16.1	-171.7	-62.8	176.9	-175.1	-168.8	-2	113.8	L189 W220 F221 E224 V230 H231 L232	L189-R228 PolarHBondContact O-NH1 3.32Å; L189-R228 PolarHBondContact O-NH2 3.26Å; W220-R228 HydrophobicContact CH2-CB 3.95Å; W220-R228 HydrophobicContact CH2-CG 3.64Å; W220-R228 HydrophobicContact CZ2-CG 4.03Å; W220-R228 HydrophobicContact CZ3-CB 3.82Å; W220-R228 HydrophobicContact CZ3-CG 3.94Å; W220-R228 VanDerWaalsContact NE1-NH1 3.15Å; W220-R228 WeakPolarHBondContact O-CD 3.46Å; W220-R228 PolarHBondContact O-NH1 3.42Å; F221-R228 HydrophobicContact CD2-CB 3.89Å; F221-R228 HydrophobicContact CE2-CB 4.48Å; E224-R228 HydrophobicContact CB-CG 4.14Å; E224-R228 VanDerWaalsContact CD-NH2 3.31Å; E224-R228 VanDerWaalsContact O-CB 3.3Å; E224-R228 WeakPolarHBondContact O-CB 3.31Å; E224-R228 WeakPolarHBondContact O-CG 3.49Å; E224-R228 PolarHBondContact O-N 3.18Å; E224-R228 VanDerWaalsContact O-N 3.14Å; E224-R228 IonicContact OE1-NH2 3.11Å; E224-R228 IonicContact OE2-CZ 2.57Å; E224-R228 IonicContact OE2-NE 2.71Å; E224-R228 PolarHBondContact OE2-NE 3.38Å; E224-R228 IonicContact OE2-NH2 2.72Å; E224-R228 PolarHBondContact OE2-NH2 3.18Å; R228-V230 PolarHBondContact O-N 3.07Å; R228-H231 PolarHBondContact O-N 3.45Å; R228-L232 PolarHBondContact O-N 3.45Å
229	E	78.7	Confident	83.2	Confident	124 Å²	124	70.4 Å²	70.4	58%	0.579	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-38	-179.8	-171	176	-169.6	0	0	112.3	F221 Q225 H231 L232	F221-E229 HydrophobicContact CE2-CB 3.97Å; F221-E229 HydrophobicContact CZ-CB 4.47Å; Q225-E229 WeakPolarHBondContact O-CB 3.23Å; Q225-E229 PolarHBondContact O-N 2.94Å; E229-H231 VanDerWaalsContact C-N 3.27Å; E229-H231 PolarHBondContact O-N 3.43Å; E229-L232 PolarHBondContact O-N 3.17Å
230	V	81.5	Confident	82.9	Confident	118 Å²	118	65.6 Å²	65.6	72%	0.715	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-30.1	179.6	-174.9	0	0	0	0	112.1	R228	R228-V230 PolarHBondContact O-N 3.07Å
231	H	80.8	Confident	82.7	Confident	58 Å²	58	66.7 Å²	66.7	27%	0.269	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-19.3	-175.8	-62.9	-47.6	0	0	0	113.5	R228 E229 E234 I235	R228-H231 PolarHBondContact O-N 3.45Å; E229-H231 VanDerWaalsContact C-N 3.27Å; E229-H231 PolarHBondContact O-N 3.43Å; H231-E234 PolarHBondContact O-N 3.11Å; H231-I235 HydrophobicContact CB-CD1 4.1Å; H231-I235 WeakPolarHBondContact O-CG1 3.47Å; H231-I235 PolarHBondContact O-N 2.92Å; H231-I235 VanDerWaalsContact O-N 3.11Å
232	L	79.8	Confident	82.3	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.016	33%	0.332	C	S	.	.	H	α-helix	trans	-54.7	-46.8	-176.6	-83.2	-172	0	0	0	114.8	I217 F221 R228 E229 E234 I235 F236 F257	I217-L232 HydrophobicContact CG2-CD2 4Å; F221-L232 HydrophobicContact CB-CD1 4.37Å; F221-L232 HydrophobicContact CB-CD2 3.95Å; F221-L232 HydrophobicContact CB-CG 4.5Å; F221-L232 HydrophobicContact CD1-CD1 3.99Å; F221-L232 HydrophobicContact CD2-CD1 3.37Å; F221-L232 HydrophobicContact CD2-CD2 4.04Å; F221-L232 HydrophobicContact CD2-CG 3.66Å; F221-L232 HydrophobicContact CE1-CD1 4.08Å; F221-L232 HydrophobicContact CE2-CD1 3.48Å; F221-L232 VanDerWaalsContact CE2-CD1 3.48Å; F221-L232 HydrophobicContact CE2-CG 4.08Å; F221-L232 HydrophobicContact CG-CD1 3.63Å; F221-L232 HydrophobicContact CG-CD2 4.1Å; F221-L232 HydrophobicContact CG-CG 4.12Å; F221-L232 HydrophobicContact CZ-CD1 3.84Å; R228-L232 PolarHBondContact O-N 3.45Å; E229-L232 PolarHBondContact O-N 3.17Å; L232-E234 VanDerWaalsContact C-N 3.25Å; L232-E234 PolarHBondContact O-N 3.14Å; L232-I235 PolarHBondContact O-N 3.48Å; L232-F236 HydrophobicContact CD2-CD2 4.22Å; L232-F236 HydrophobicContact CD2-CE2 3.81Å; L232-F236 WeakPolarHBondContact O-CB 3.31Å; L232-F236 WeakPolarHBondContact O-CD2 3.48Å; L232-F236 PolarHBondContact O-N 3.1Å; L232-F257 HydrophobicContact CD1-CE1 3.63Å; L232-F257 HydrophobicContact CD1-CZ 3.89Å
233	P	79.2	Confident	82	Confident	77 Å²	77	63 Å²	63	50%	0.5	33%	0.326	S	S	.	.	H	α-helix	trans	-61.8	-34.6	-178.1	-23.8	34.8	0	0	0	113	A237	P233-A237 WeakPolarHBondContact O-CB 3.43Å; P233-A237 PolarHBondContact O-N 2.95Å; P233-A237 VanDerWaalsContact O-N 3.15Å
234	E	82.3	Confident	81.7	Confident	80 Å²	80	60.2 Å²	60.2	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-71.3	-44.9	177.2	-174.5	180	179.7	0	0	111.3	H231 L232 F236 A237 K238	H231-E234 PolarHBondContact O-N 3.11Å; L232-E234 VanDerWaalsContact C-N 3.25Å; L232-E234 PolarHBondContact O-N 3.14Å; E234-F236 VanDerWaalsContact C-N 3.34Å; E234-F236 PolarHBondContact O-N 2.99Å; E234-A237 PolarHBondContact O-N 2.83Å; E234-K238 HydrophobicContact CG-CD 4.25Å; E234-K238 PolarHBondContact O-N 3.42Å; E234-K238 VanDerWaalsContact O-N 3.13Å; E234-K238 IonicContact OE1-NZ 2.72Å; E234-K238 PolarHBondContact OE1-NZ 3.32Å
235	I	84.1	Confident	81.6	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-46.1	177.8	-65.5	165.1	0	0	0	109.9	L196 I197 I217 W220 H231 L232 A237 K238 C239	L196-I235 HydrophobicContact CD2-CD1 4.31Å; L196-I235 HydrophobicContact CD2-CG2 4.38Å; I197-I235 HydrophobicContact CD1-CG1 4.09Å; I197-I235 HydrophobicContact CG1-CG1 4.1Å; I217-I235 HydrophobicContact CD1-CG2 4.01Å; I217-I235 HydrophobicContact CG1-CG2 4.19Å; I217-I235 HydrophobicContact CG2-CG2 3.9Å; W220-I235 HydrophobicContact CE3-CD1 4.33Å; W220-I235 HydrophobicContact CH2-CD1 3.71Å; W220-I235 HydrophobicContact CZ3-CD1 3.45Å; W220-I235 VanDerWaalsContact CZ3-CD1 3.45Å; H231-I235 HydrophobicContact CB-CD1 4.1Å; H231-I235 WeakPolarHBondContact O-CG1 3.47Å; H231-I235 PolarHBondContact O-N 2.92Å; H231-I235 VanDerWaalsContact O-N 3.11Å; L232-I235 PolarHBondContact O-N 3.48Å; I235-A237 PolarHBondContact O-N 3.42Å; I235-K238 PolarHBondContact O-N 3.14Å; I235-C239 HydrophobicContact CG2-CB 4.38Å; I235-C239 WeakPolarHBondContact O-CB 3.5Å; I235-C239 PolarHBondContact O-N 3.22Å; I235-C239 PolarHBondContact O-SG 2.67Å
236	F	83.1	Confident	81.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-43.3	179.9	-88	-124.8	0	0	0	112.3	Y214 I217 I218 L232 E234 K238 I240 F242 F257 A260	Y214-F236 AromaticContact CD2-CE1 3.9Å; Y214-F236 HydrophobicContact CD2-CE1 3.9Å; Y214-F236 HydrophobicContact CD2-CZ 4.04Å; Y214-F236 AromaticContact CE2-CE1 3.64Å; Y214-F236 HydrophobicContact CE2-CE1 3.64Å; Y214-F236 AromaticContact CE2-CZ 3.8Å; Y214-F236 HydrophobicContact CE2-CZ 3.8Å; I217-F236 HydrophobicContact CB-CE2 4.39Å; I217-F236 HydrophobicContact CG2-CD2 4.13Å; I217-F236 HydrophobicContact CG2-CE2 3.55Å; I217-F236 HydrophobicContact CG2-CZ 4.48Å; I218-F236 HydrophobicContact CD1-CE2 4.46Å; I218-F236 HydrophobicContact CD1-CZ 3.94Å; L232-F236 HydrophobicContact CD2-CD2 4.22Å; L232-F236 HydrophobicContact CD2-CE2 3.81Å; L232-F236 WeakPolarHBondContact O-CB 3.31Å; L232-F236 WeakPolarHBondContact O-CD2 3.48Å; L232-F236 PolarHBondContact O-N 3.1Å; E234-F236 VanDerWaalsContact C-N 3.34Å; E234-F236 PolarHBondContact O-N 2.99Å; F236-K238 VanDerWaalsContact C-N 3.34Å; F236-K238 PolarHBondContact O-N 3.01Å; F236-I240 HydrophobicContact CB-CD1 4.32Å; F236-I240 HydrophobicContact CD1-CD1 3.57Å; F236-I240 HydrophobicContact CD2-CD1 4.02Å; F236-I240 HydrophobicContact CE1-CD1 3.69Å; F236-I240 HydrophobicContact CE2-CD1 4.14Å; F236-I240 HydrophobicContact CG-CD1 3.71Å; F236-I240 HydrophobicContact CZ-CD1 3.96Å; F236-I240 PolarHBondContact O-N 3.19Å; F236-F242 AromaticContact CD1-CZ 3.96Å; F236-F242 HydrophobicContact CD1-CZ 3.96Å; F236-F257 HydrophobicContact CD1-CB 4.5Å; F236-F257 HydrophobicContact CE1-CB 4.29Å; F236-F257 HydrophobicContact CE1-CD1 4.42Å; F236-F257 HydrophobicContact CE1-CG 4.18Å; F236-A260 HydrophobicContact CB-CB 4Å
237	A	78.7	Confident	81.7	Confident	57 Å²	57	55.4 Å²	55.4	47%	0.471	29%	0.291	S	S	.	.	H	α-helix	trans	-65.7	-36	-179.5	0	0	0	0	0	112.8	P233 E234 I235	P233-A237 WeakPolarHBondContact O-CB 3.43Å; P233-A237 PolarHBondContact O-N 2.95Å; P233-A237 VanDerWaalsContact O-N 3.15Å; E234-A237 PolarHBondContact O-N 2.83Å; I235-A237 PolarHBondContact O-N 3.42Å
238	K	82	Confident	81.8	Confident	107 Å²	107	52.4 Å²	52.4	47%	0.465	28%	0.283	S	S	.	.	H	α-helix	trans	-85.7	-41.6	-179.5	-70.2	178.1	175.2	171	0	112.9	I197 E234 I235 F236	I197-K238 HydrophobicContact CD1-CD 4.34Å; I197-K238 HydrophobicContact CG2-CB 4.48Å; I197-K238 HydrophobicContact CG2-CD 4.13Å; E234-K238 HydrophobicContact CG-CD 4.25Å; E234-K238 PolarHBondContact O-N 3.42Å; E234-K238 VanDerWaalsContact O-N 3.13Å; E234-K238 IonicContact OE1-NZ 2.72Å; E234-K238 PolarHBondContact OE1-NZ 3.32Å; I235-K238 PolarHBondContact O-N 3.14Å; F236-K238 VanDerWaalsContact C-N 3.34Å; F236-K238 PolarHBondContact O-N 3.01Å
239	C	84.3	Confident	81.7	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	29%	0.289	C	S	.	.	H	α-helix	trans	-95.4	-28.8	-164.6	-56.7	0	0	0	0	114.1	L200 I217 I235 R279	L200-C239 HydrophobicContact CB-CB 3.77Å; L200-C239 HydrophobicContact CD1-CB 4.21Å; I217-C239 HydrophobicContact CD1-CB 4.19Å; I235-C239 HydrophobicContact CG2-CB 4.38Å; I235-C239 WeakPolarHBondContact O-CB 3.5Å; I235-C239 PolarHBondContact O-N 3.22Å; I235-C239 PolarHBondContact O-SG 2.67Å; C239-R279 PolarHBondContact O-NH2 2.71Å
240	I	84.3	Confident	81.7	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	27%	0.273	C	S	.	.			trans	-101.1	129.1	-170.9	-60.8	171.4	0	0	0	111.3	E210 Y214 I217 F236 F242 M245	E210-I240 HydrophobicContact CG-CG2 4.43Å; Y214-I240 HydrophobicContact CD2-CD1 3.99Å; I217-I240 HydrophobicContact CD1-CD1 3.73Å; I217-I240 HydrophobicContact CD1-CG1 3.63Å; F236-I240 HydrophobicContact CB-CD1 4.32Å; F236-I240 HydrophobicContact CD1-CD1 3.57Å; F236-I240 HydrophobicContact CD2-CD1 4.02Å; F236-I240 HydrophobicContact CE1-CD1 3.69Å; F236-I240 HydrophobicContact CE2-CD1 4.14Å; F236-I240 HydrophobicContact CG-CD1 3.71Å; F236-I240 HydrophobicContact CZ-CD1 3.96Å; F236-I240 PolarHBondContact O-N 3.19Å; I240-F242 HydrophobicContact CB-CD2 4.5Å; I240-F242 HydrophobicContact CB-CE2 4.07Å; I240-F242 HydrophobicContact CB-CZ 4.14Å; I240-F242 HydrophobicContact CD1-CZ 4.39Å; I240-F242 HydrophobicContact CG2-CD1 3.99Å; I240-F242 HydrophobicContact CG2-CD2 4.08Å; I240-F242 HydrophobicContact CG2-CE1 3.82Å; I240-F242 HydrophobicContact CG2-CE2 3.95Å; I240-F242 HydrophobicContact CG2-CG 4.12Å; I240-F242 HydrophobicContact CG2-CZ 3.82Å; I240-F242 PolarHBondContact O-N 3.29Å; I240-M245 HydrophobicContact CG2-SD 3.89Å
241	R	85.9	Confident	81.5	Confident	28 Å²	28	52.5 Å²	52.5	11%	0.106	28%	0.276	C	S	.	.			trans	-96.8	74.6	175.8	-60.5	170.6	-162	-160.8	-1.5	110.6	D201 D203 E210 P243 L244 T277	D201-R241 PolarHBondContact O-NH2 2.89Å; D203-R241 IonicContact OD1-CZ 3.42Å; D203-R241 IonicContact OD1-NH1 3.65Å; D203-R241 PolarHBondContact OD1-NH1 3.41Å; D203-R241 IonicContact OD1-NH2 3.66Å; D203-R241 PolarHBondContact OD1-NH2 2.81Å; E210-R241 HydrophobicContact CG-CB 4.17Å; E210-R241 PolarHBondContact OE1-N 2.94Å; R241-P243 VanDerWaalsContact C-N 3.26Å; R241-P243 VanDerWaalsContact O-N 3.08Å; R241-L244 HydrophobicContact CB-CB 4.45Å; R241-L244 HydrophobicContact CB-CD1 3.91Å; R241-L244 HydrophobicContact CB-CG 4.22Å; R241-L244 PolarHBondContact O-N 2.9Å; R241-T277 PolarHBondContact NH1-O 3.01Å; R241-T277 PolarHBondContact NH1-OG1 3.25Å
242	F	79.9	Confident	81.5	Confident	1 Å²	1	57.5 Å²	57.5	0%	0.004	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-47.4	-37	-179.5	-66.4	-77.4	0	0	0	115.5	F236 I240 L244 M245 I253 V261	F236-F242 AromaticContact CD1-CZ 3.96Å; F236-F242 HydrophobicContact CD1-CZ 3.96Å; I240-F242 HydrophobicContact CB-CD2 4.5Å; I240-F242 HydrophobicContact CB-CE2 4.07Å; I240-F242 HydrophobicContact CB-CZ 4.14Å; I240-F242 HydrophobicContact CD1-CZ 4.39Å; I240-F242 HydrophobicContact CG2-CD1 3.99Å; I240-F242 HydrophobicContact CG2-CD2 4.08Å; I240-F242 HydrophobicContact CG2-CE1 3.82Å; I240-F242 HydrophobicContact CG2-CE2 3.95Å; I240-F242 HydrophobicContact CG2-CG 4.12Å; I240-F242 HydrophobicContact CG2-CZ 3.82Å; I240-F242 PolarHBondContact O-N 3.29Å; F242-L244 PolarHBondContact O-N 3.48Å; F242-L244 VanDerWaalsContact O-N 3.09Å; F242-M245 HydrophobicContact CD1-SD 3.95Å; F242-M245 HydrophobicContact CE1-SD 4.4Å; F242-M245 PolarHBondContact O-N 3.47Å; F242-M245 VanDerWaalsContact O-N 3.13Å; F242-I253 HydrophobicContact CE1-CD1 4.13Å; F242-V261 HydrophobicContact CD1-CG1 4.37Å; F242-V261 HydrophobicContact CD1-CG2 3.94Å; F242-V261 HydrophobicContact CE1-CB 4.43Å; F242-V261 HydrophobicContact CE1-CG2 3.51Å; F242-V261 HydrophobicContact CE2-CG2 4.49Å; F242-V261 HydrophobicContact CZ-CG2 3.81Å
243	P	80.2	Confident	81.4	Confident	66 Å²	66	58.2 Å²	58.2	43%	0.429	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-63.5	-13.3	177.2	-24.3	35.5	0	0	0	115.6	R241	R241-P243 VanDerWaalsContact C-N 3.26Å; R241-P243 VanDerWaalsContact O-N 3.08Å
244	L	82.1	Confident	81.2	Confident	46 Å²	46	56.9 Å²	56.9	24%	0.241	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-99.6	-0.9	179.2	-60.5	178.7	0	0	0	113	E210 R241 F242 Q278 M282	E210-L244 HydrophobicContact CB-CB 4.3Å; R241-L244 HydrophobicContact CB-CB 4.45Å; R241-L244 HydrophobicContact CB-CD1 3.91Å; R241-L244 HydrophobicContact CB-CG 4.22Å; R241-L244 PolarHBondContact O-N 2.9Å; F242-L244 PolarHBondContact O-N 3.48Å; F242-L244 VanDerWaalsContact O-N 3.09Å; L244-Q278 HydrophobicContact CD2-CG 4.28Å; L244-M282 HydrophobicContact CB-CE 4.3Å; L244-M282 HydrophobicContact CD1-CE 4.28Å; L244-M282 HydrophobicContact CD1-SD 3.93Å
245	M	83.3	Confident	80.5	Confident	12 Å²	12	58.5 Å²	58.5	6%	0.059	31%	0.31	C	S	.	.	S	Bend	trans	-89.3	153.2	177.3	-65.7	178.2	66.8	0	0	111.1	E210 E211 Y214 I240 F242 F249 I250 I253	E210-M245 HydrophobicContact CB-CG 3.73Å; E210-M245 HydrophobicContact CG-CG 3.88Å; E210-M245 HydrophobicContact CG-SD 4.45Å; E211-M245 HydrophobicContact CG-CE 4.25Å; Y214-M245 HydrophobicContact CG-CE 4.47Å; I240-M245 HydrophobicContact CG2-SD 3.89Å; F242-M245 HydrophobicContact CD1-SD 3.95Å; F242-M245 HydrophobicContact CE1-SD 4.4Å; F242-M245 PolarHBondContact O-N 3.47Å; F242-M245 VanDerWaalsContact O-N 3.13Å; M245-F249 HydrophobicContact CE-CD1 3.15Å; M245-F249 HydrophobicContact CE-CE1 3.37Å; M245-F249 HydrophobicContact CE-CG 4.19Å; M245-I250 HydrophobicContact CB-CD1 4.24Å; M245-I250 HydrophobicContact CB-CG1 4.07Å; M245-I253 HydrophobicContact CE-CD1 4.06Å
246	E	82.1	Confident	79.6	Confident	93 Å²	93	65 Å²	65	44%	0.435	34%	0.34	S	S	.	.			trans	-67.5	137.5	171.9	-78.1	-177.6	-160.8	0	0	112.5	R209 E211 T248 F249 I250	R209-E246 IonicContact CZ-OE1 3.09Å; R209-E246 VanDerWaalsContact CZ-OE1 3.3Å; R209-E246 IonicContact NH1-OE1 2.76Å; R209-E246 PolarHBondContact NH1-OE1 2.85Å; R209-E246 VanDerWaalsContact NH1-OE1 3.07Å; R209-E246 IonicContact NH2-OE1 3.38Å; R209-E246 PolarHBondContact NH2-OE1 3.37Å; R209-E246 IonicContact NH2-OE2 3.4Å; E211-E246 PolarHBondContact OE1-N 3.09Å; E211-E246 VanDerWaalsContact OE1-N 3.11Å; E246-T248 PolarHBondContact O-N 3.13Å; E246-F249 HydrophobicContact CB-CB 4.46Å; E246-F249 WeakPolarHBondContact O-CA 3.44Å; E246-F249 WeakPolarHBondContact O-CB 3.39Å; E246-F249 PolarHBondContact O-N 3.47Å; E246-I250 PolarHBondContact O-N 2.98Å; E246-I250 VanDerWaalsContact O-N 3.11Å
247	D	79.6	Confident	78.7	Confident	128 Å²	128	65.9 Å²	65.9	68%	0.684	34%	0.344	S	S	*	.	H	α-helix	trans	-55.1	-38.8	179.1	-64.8	-32.1	0	0	0	112.5	F249 I250 E251	D247-F249 PolarHBondContact O-N 3.45Å; D247-I250 PolarHBondContact O-N 3.15Å; D247-E251 PolarHBondContact O-N 3.37Å; D247-E251 VanDerWaalsContact O-N 3.16Å
248	T	83.2	Confident	78	Confident	80 Å²	80	65.6 Å²	65.6	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-64.9	-24.9	178	71.5	0	0	0	0	113.4	E246 K252	E246-T248 PolarHBondContact O-N 3.13Å; T248-K252 WeakPolarHBondContact O-CG 3.3Å
249	F	81.1	Confident	76.9	Confident	45 Å²	45	67.5 Å²	67.5	20%	0.197	35%	0.352	C	S	.	.	H	α-helix	trans	-83.2	-40.1	176.6	-168.2	-79.6	0	0	0	110.3	E211 Y214 M245 E246 D247 E251 K252 I253	E211-F249 HydrophobicContact CB-CE2 4.26Å; E211-F249 HydrophobicContact CB-CZ 4.32Å; E211-F249 HydrophobicContact CG-CB 4.42Å; E211-F249 HydrophobicContact CG-CD1 4.18Å; E211-F249 HydrophobicContact CG-CD2 3.9Å; E211-F249 HydrophobicContact CG-CE1 4.38Å; E211-F249 HydrophobicContact CG-CE2 4.14Å; E211-F249 HydrophobicContact CG-CG 3.9Å; E211-F249 HydrophobicContact CG-CZ 4.36Å; Y214-F249 AromaticContact CD1-CE1 3.62Å; Y214-F249 HydrophobicContact CD1-CE1 3.62Å; Y214-F249 AromaticContact CD1-CZ 3.66Å; Y214-F249 HydrophobicContact CD1-CZ 3.66Å; Y214-F249 AromaticContact CE1-CE1 3.85Å; Y214-F249 HydrophobicContact CE1-CE1 3.85Å; Y214-F249 AromaticContact CE1-CZ 3.91Å; Y214-F249 HydrophobicContact CE1-CZ 3.91Å; Y214-F249 HydrophobicContact CG-CE1 4.11Å; Y214-F249 HydrophobicContact CG-CZ 4.5Å; M245-F249 HydrophobicContact CE-CD1 3.15Å; M245-F249 HydrophobicContact CE-CE1 3.37Å; M245-F249 HydrophobicContact CE-CG 4.19Å; E246-F249 HydrophobicContact CB-CB 4.46Å; E246-F249 WeakPolarHBondContact O-CA 3.44Å; E246-F249 WeakPolarHBondContact O-CB 3.39Å; E246-F249 PolarHBondContact O-N 3.47Å; D247-F249 PolarHBondContact O-N 3.45Å; F249-E251 VanDerWaalsContact C-N 3.25Å; F249-E251 PolarHBondContact O-N 3.16Å; F249-K252 WeakPolarHBondContact O-CB 3.24Å; F249-K252 PolarHBondContact O-N 3.32Å; F249-I253 HydrophobicContact CD1-CD1 4.44Å; F249-I253 HydrophobicContact CD1-CG1 4.3Å; F249-I253 HydrophobicContact CE1-CG1 4.34Å; F249-I253 PolarHBondContact O-N 3.18Å
250	I	79	Confident	75.8	Confident	47 Å²	47	68 Å²	68	24%	0.241	36%	0.356	C	S	.	.	H	α-helix	trans	-57.8	-40.4	177.3	-63.1	173.1	0	0	0	110.9	M245 E246 D247 K252 I253 V261	M245-I250 HydrophobicContact CB-CD1 4.24Å; M245-I250 HydrophobicContact CB-CG1 4.07Å; E246-I250 PolarHBondContact O-N 2.98Å; E246-I250 VanDerWaalsContact O-N 3.11Å; D247-I250 PolarHBondContact O-N 3.15Å; I250-K252 PolarHBondContact O-N 3.25Å; I250-I253 WeakPolarHBondContact O-CB 3.27Å; I250-I253 PolarHBondContact O-N 3.14Å; I250-I253 VanDerWaalsContact O-N 3.16Å; I250-V261 HydrophobicContact CG2-CG1 4.4Å
251	E	77.4	Confident	74.7	Confident	168 Å²	168	68.8 Å²	68.8	79%	0.785	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-25	176.2	-71	-179.3	174.8	0	0	114	D247 F249	D247-E251 PolarHBondContact O-N 3.37Å; D247-E251 VanDerWaalsContact O-N 3.16Å; F249-E251 VanDerWaalsContact C-N 3.25Å; F249-E251 PolarHBondContact O-N 3.16Å
252	K	80.5	Confident	73.5	Confident	163 Å²	163	69.9 Å²	69.9	71%	0.709	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-11	179.2	-65.7	173	-175	171	0	113.1	T248 F249 I250	T248-K252 WeakPolarHBondContact O-CG 3.3Å; F249-K252 WeakPolarHBondContact O-CB 3.24Å; F249-K252 PolarHBondContact O-N 3.32Å; I250-K252 PolarHBondContact O-N 3.25Å
253	I	77.5	Confident	72.5	Confident	18 Å²	18	76.2 Å²	76.2	9%	0.092	40%	0.404	C	S	.	.	S	Bend	trans	-68.1	130.7	-178.2	-62.5	177.4	0	0	0	109.1	Y214 F242 M245 F249 I250 F257	Y214-I253 HydrophobicContact CE2-CD1 4.21Å; Y214-I253 HydrophobicContact CE2-CG1 4.23Å; Y214-I253 HydrophobicContact CE2-CG2 4.24Å; F242-I253 HydrophobicContact CE1-CD1 4.13Å; M245-I253 HydrophobicContact CE-CD1 4.06Å; F249-I253 HydrophobicContact CD1-CD1 4.44Å; F249-I253 HydrophobicContact CD1-CG1 4.3Å; F249-I253 HydrophobicContact CE1-CG1 4.34Å; F249-I253 PolarHBondContact O-N 3.18Å; I250-I253 WeakPolarHBondContact O-CB 3.27Å; I250-I253 PolarHBondContact O-N 3.14Å; I250-I253 VanDerWaalsContact O-N 3.16Å; I253-F257 HydrophobicContact CG2-CB 3.9Å; I253-F257 HydrophobicContact CG2-CD2 4.09Å; I253-F257 HydrophobicContact CG2-CG 4.49Å
254	P	75.4	Confident	71.3	Confident	48 Å²	48	74.3 Å²	74.3	31%	0.312	39%	0.392	S	S	.	.			trans	-53.6	139.6	178.9	-29.6	35.8	0	0	0	113.1	Q256 F257	P254-Q256 HydrophobicContact CB-CG 3.95Å; P254-Q256 PolarHBondContact O-N 3.07Å; P254-F257 HydrophobicContact CB-CD2 3.94Å; P254-F257 HydrophobicContact CB-CE2 4.07Å; P254-F257 HydrophobicContact CG-CD2 4.22Å; P254-F257 HydrophobicContact CG-CE2 4.14Å; P254-F257 PolarHBondContact O-N 2.84Å
255	P	66.3	Low	69.7	Low	115 Å²	115	74.7 Å²	74.7	75%	0.747	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-63.6	-20.3	-172.4	24.1	-34	0	0	0	113.7	F257 A258	P255-F257 PolarHBondContact O-N 3.05Å; P255-F257 VanDerWaalsContact O-N 3.17Å; P255-A258 WeakPolarHBondContact O-CB 3.39Å; P255-A258 PolarHBondContact O-N 3.42Å
256	Q	65.9	Low	68.1	Low	136 Å²	136	79.9 Å²	79.9	64%	0.636	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-58.9	-21.7	171.8	67	-162.6	21	0	0	113.4	P254	P254-Q256 HydrophobicContact CB-CG 3.95Å; P254-Q256 PolarHBondContact O-N 3.07Å
257	F	64.9	Low	66.5	Low	19 Å²	19	83.6 Å²	83.6	8%	0.083	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-100.7	-2.8	177.7	-52.6	-55.3	0	0	0	113.5	L232 F236 I253 P254 P255 Q259 A260 V261	L232-F257 HydrophobicContact CD1-CE1 3.63Å; L232-F257 HydrophobicContact CD1-CZ 3.89Å; F236-F257 HydrophobicContact CD1-CB 4.5Å; F236-F257 HydrophobicContact CE1-CB 4.29Å; F236-F257 HydrophobicContact CE1-CD1 4.42Å; F236-F257 HydrophobicContact CE1-CG 4.18Å; I253-F257 HydrophobicContact CG2-CB 3.9Å; I253-F257 HydrophobicContact CG2-CD2 4.09Å; I253-F257 HydrophobicContact CG2-CG 4.49Å; P254-F257 HydrophobicContact CB-CD2 3.94Å; P254-F257 HydrophobicContact CB-CE2 4.07Å; P254-F257 HydrophobicContact CG-CD2 4.22Å; P254-F257 HydrophobicContact CG-CE2 4.14Å; P254-F257 PolarHBondContact O-N 2.84Å; P255-F257 PolarHBondContact O-N 3.05Å; P255-F257 VanDerWaalsContact O-N 3.17Å; F257-Q259 PolarHBondContact O-N 3.43Å; F257-Q259 VanDerWaalsContact O-N 3.14Å; F257-A260 PolarHBondContact O-N 3.09Å; F257-V261 WeakPolarHBondContact O-CG2 3.35Å; F257-V261 PolarHBondContact O-N 3.24Å
258	A	62.1	Low	64.9	Low	52 Å²	52	83.1 Å²	83.1	43%	0.43	44%	0.439	S	S	.	.	H	α-helix	trans	-60.8	-26.5	-177.4	0	0	0	0	0	113.1	P255 A262	P255-A258 WeakPolarHBondContact O-CB 3.39Å; P255-A258 PolarHBondContact O-N 3.42Å; A258-A262 VanDerWaalsContact O-CB 3.23Å; A258-A262 WeakPolarHBondContact O-CB 3.41Å; A258-A262 PolarHBondContact O-N 3.07Å
259	Q	60.7	Low	62.9	Low	146 Å²	146	81.2 Å²	81.2	68%	0.682	44%	0.436	S	S	*	.	H	α-helix	trans	-71.6	-33.1	176.7	-163.5	174.5	17.7	0	0	112.8	F257 K263	F257-Q259 PolarHBondContact O-N 3.43Å; F257-Q259 VanDerWaalsContact O-N 3.14Å; Q259-K263 WeakPolarHBondContact O-CG 3.15Å; Q259-K263 PolarHBondContact O-N 2.92Å; Q259-K263 VanDerWaalsContact O-N 3.07Å
260	A	60.5	Low	60.9	Low	11 Å²	11	85.7 Å²	85.7	9%	0.091	47%	0.469	C	S	.	.	H	α-helix	trans	-73.3	-40.4	173.9	0	0	0	0	0	111	F236 F257 K263 S264	F236-A260 HydrophobicContact CB-CB 4Å; F257-A260 PolarHBondContact O-N 3.09Å; A260-K263 PolarHBondContact O-N 3.18Å; A260-S264 PolarHBondContact O-N 3.43Å; A260-S264 VanDerWaalsContact O-N 3.09Å
261	V	61.8	Low	59.2	Low	23 Å²	23	88.6 Å²	88.6	14%	0.139	49%	0.494	C	S	.	.	H	α-helix	trans	-57.6	-48.7	171	-179.5	0	0	0	0	110.1	F242 I250 F257 K263 S264 C265	F242-V261 HydrophobicContact CD1-CG1 4.37Å; F242-V261 HydrophobicContact CD1-CG2 3.94Å; F242-V261 HydrophobicContact CE1-CB 4.43Å; F242-V261 HydrophobicContact CE1-CG2 3.51Å; F242-V261 HydrophobicContact CE2-CG2 4.49Å; F242-V261 HydrophobicContact CZ-CG2 3.81Å; I250-V261 HydrophobicContact CG2-CG1 4.4Å; F257-V261 WeakPolarHBondContact O-CG2 3.35Å; F257-V261 PolarHBondContact O-N 3.24Å; V261-K263 PolarHBondContact O-N 2.76Å; V261-S264 PolarHBondContact O-N 2.81Å; V261-C265 WeakPolarHBondContact O-CB 3.47Å; V261-C265 PolarHBondContact O-N 2.65Å; V261-C265 PolarHBondContact O-SG 3.01Å
262	A	59.1	Low	57.4	Low	51 Å²	51	86 Å²	86	42%	0.421	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-41.4	-179.3	0	0	0	0	0	112.8	A258 C265 V266	A258-A262 VanDerWaalsContact O-CB 3.23Å; A258-A262 WeakPolarHBondContact O-CB 3.41Å; A258-A262 PolarHBondContact O-N 3.07Å; A262-C265 PolarHBondContact O-N 2.72Å; A262-V266 VanDerWaalsContact O-CB 3.26Å; A262-V266 WeakPolarHBondContact O-CB 3.44Å; A262-V266 WeakPolarHBondContact O-CG2 3.41Å; A262-V266 PolarHBondContact O-N 2.92Å
263	K	59.7	Low	55.7	Low	134 Å²	134	84.1 Å²	84.1	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-63.7	-44.1	176	-78.9	-178.7	178.2	-179.1	0	112.2	Q259 A260 V261 V266 E267	Q259-K263 WeakPolarHBondContact O-CG 3.15Å; Q259-K263 PolarHBondContact O-N 2.92Å; Q259-K263 VanDerWaalsContact O-N 3.07Å; A260-K263 PolarHBondContact O-N 3.18Å; V261-K263 PolarHBondContact O-N 2.76Å; K263-V266 PolarHBondContact O-N 3.06Å; K263-E267 PolarHBondContact O-N 3.44Å; K263-E267 VanDerWaalsContact O-N 3.08Å
264	S	54.4	Low	54.1	Low	25 Å²	25	90.2 Å²	90.2	18%	0.175	52%	0.521	C	S	.	.	H	α-helix	trans	-63.9	-41.1	178.1	-173.8	0	0	0	0	112.4	A260 V261	A260-S264 PolarHBondContact O-N 3.43Å; A260-S264 VanDerWaalsContact O-N 3.09Å; V261-S264 PolarHBondContact O-N 2.81Å
265	C	50.1	Low	53	Low	55 Å²	55	90.1 Å²	90.1	37%	0.372	53%	0.528	S	S	.	.	H	α-helix	trans	-74	-22.4	176.8	-65.6	0	0	0	0	113.9	V261 A262 K268	V261-C265 WeakPolarHBondContact O-CB 3.47Å; V261-C265 PolarHBondContact O-N 2.65Å; V261-C265 PolarHBondContact O-SG 3.01Å; A262-C265 PolarHBondContact O-N 2.72Å; C265-K268 CarbonylContact O-C 3.59Å
266	V	48.7	Very low	53	Low	121 Å²	121	85.8 Å²	85.8	73%	0.733	50%	0.501	S	S	*	.	H	α-helix	trans	-85.1	-35.5	178.6	168.7	0	0	0	0	112.1	A262 K263 K268	A262-V266 VanDerWaalsContact O-CB 3.26Å; A262-V266 WeakPolarHBondContact O-CB 3.44Å; A262-V266 WeakPolarHBondContact O-CG2 3.41Å; A262-V266 PolarHBondContact O-N 2.92Å; K263-V266 PolarHBondContact O-N 3.06Å; V266-K268 PolarHBondContact O-N 2.93Å
267	E	47.8	Very low	53.5	Low	171 Å²	171	83.1 Å²	83.1	80%	0.799	49%	0.494	S	S	*	.	H	α-helix	trans	-70.4	-21.6	174.9	-74.2	-175.6	175.7	0	0	113	K263	K263-E267 PolarHBondContact O-N 3.44Å; K263-E267 VanDerWaalsContact O-N 3.08Å
268	K	47.3	Very low	54.4	Low	117 Å²	117	87.5 Å²	87.5	51%	0.509	51%	0.514	S	S	.	.	S	Bend	trans	-133.1	90.2	176.1	-66.1	-176.4	-177.9	-173.9	0	109.1	C265 V266 G275	C265-K268 CarbonylContact O-C 3.59Å; V266-K268 PolarHBondContact O-N 2.93Å; K268-G275 PolarHBondContact NZ-O 2.89Å
269	G	40.9	Very low	55.5	Low	41 Å²	41	85 Å²	85	42%	0.423	49%	0.494	S	S	.	.			trans	-50	163.6	-172.3	0	0	0	0	0	116.1	S271	G269-S271 PolarHBondContact O-N 3.46Å
270	P	40	Very low	56.5	Low	138 Å²	138	79 Å²	79	90%	0.896	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	22.2	-157.9	32.4	-37.3	0	0	0	115.5
271	S	42.6	Very low	57.4	Low	109 Å²	109	78.7 Å²	78.7	76%	0.762	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.6	14.1	-173.2	54.3	0	0	0	0	115.4	G269	G269-S271 PolarHBondContact O-N 3.46Å
272	N	40	Very low	58.4	Low	113 Å²	113	79.5 Å²	79.5	60%	0.604	47%	0.467	S	S	*	.			trans	-125.6	84.8	176.1	-114	-9.9	0	0	0	111.6	N274	N272-N274 PolarHBondContact O-N 2.86Å; N272-N274 VanDerWaalsContact O-N 3.1Å; N272-N274 PolarHBondContact OD1-ND2 2.88Å
273	T	44.7	Very low	59.5	Low	124 Å²	124	78 Å²	78	76%	0.761	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-60.7	-8.5	162.1	47.1	0	0	0	0	112.8	G275	T273-G275 VanDerWaalsContact C-N 3.26Å; T273-G275 PolarHBondContact O-N 2.84Å
274	N	44.4	Very low	60.8	Low	146 Å²	146	73.1 Å²	73.1	78%	0.781	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-74.8	0.9	-179.5	-71.7	-30.1	0	0	0	115.5	N272	N272-N274 PolarHBondContact O-N 2.86Å; N272-N274 VanDerWaalsContact O-N 3.1Å; N272-N274 PolarHBondContact OD1-ND2 2.88Å
275	G	52.1	Low	62.3	Low	45 Å²	45	73.1 Å²	73.1	46%	0.464	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-126.7	4.9	-175.8	0	0	0	0	0	116.3	K268 T273	K268-G275 PolarHBondContact NZ-O 2.89Å; T273-G275 VanDerWaalsContact C-N 3.26Å; T273-G275 PolarHBondContact O-N 2.84Å
276	C	64.5	Low	64.2	Low	25 Å²	25	73.1 Å²	73.1	17%	0.169	43%	0.432	C	S	.	.	S	Bend	trans	-113.7	110.7	174.8	-164.1	0	0	0	0	108.5	Q278	C276-Q278 PolarHBondContact O-N 3.05Å
277	T	78.3	Confident	66.2	Low	80 Å²	80	67.4 Å²	67.4	49%	0.491	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-64.7	129.2	174.7	43.9	0	0	0	0	108.2	D203 R241	D203-T277 PolarHBondContact OD1-OG1 2.75Å; D203-T277 PolarHBondContact OD2-OG1 2.82Å; R241-T277 PolarHBondContact NH1-O 3.01Å; R241-T277 PolarHBondContact NH1-OG1 3.25Å
278	Q	82.3	Confident	68.2	Low	110 Å²	110	59.2 Å²	59.2	51%	0.514	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-67.9	144.3	169.3	-71.2	179.2	-29.5	0	0	108.7	L244 C276 M282 T283	L244-Q278 HydrophobicContact CD2-CG 4.28Å; C276-Q278 PolarHBondContact O-N 3.05Å; Q278-M282 HydrophobicContact CB-CB 4.23Å; Q278-M282 HydrophobicContact CB-SD 4.23Å; Q278-M282 HydrophobicContact CG-SD 4.47Å; Q278-T283 HydrophobicContact CB-CG2 4.21Å
279	R	84.9	Confident	70.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-66.9	153.4	171.9	-63.3	-174	-171.4	-88.3	6.8	110	L200 S202 D203 E210 C239 G281 M282	L200-R279 PolarHBondContact O-NH1 3.22Å; S202-R279 PolarHBondContact O-NH1 2.8Å; D203-R279 CarbonylContact O-C 3.46Å; D203-R279 WeakPolarHBondContact O-CA 3.48Å; E210-R279 IonicContact OE1-CZ 3.01Å; E210-R279 IonicContact OE1-NE 2.65Å; E210-R279 PolarHBondContact OE1-NE 2.87Å; E210-R279 IonicContact OE1-NH2 2.64Å; E210-R279 PolarHBondContact OE1-NH2 2.72Å; E210-R279 WeakPolarHBondContact OE2-CD 3.47Å; E210-R279 IonicContact OE2-CZ 3.49Å; E210-R279 IonicContact OE2-NE 3.24Å; E210-R279 PolarHBondContact OE2-NE 2.8Å; E210-R279 IonicContact OE2-NH2 3.26Å; C239-R279 PolarHBondContact O-NH2 2.71Å; R279-G281 VanDerWaalsContact C-N 3.26Å; R279-G281 PolarHBondContact O-N 2.81Å; R279-M282 HydrophobicContact CB-CG 4.3Å; R279-M282 HydrophobicContact CB-SD 4.38Å; R279-M282 WeakPolarHBondContact O-CB 3.28Å; R279-M282 PolarHBondContact O-N 3.13Å
280	L	81.9	Confident	72.5	Confident	20 Å²	20	51.7 Å²	51.7	11%	0.105	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-50.2	-47.2	-178.6	-177.7	65.9	0	0	0	112	D203 M282 T283 Y593	D203-L280 PolarHBondContact O-N 3.47Å; L280-M282 VanDerWaalsContact C-N 3.29Å; L280-M282 PolarHBondContact O-N 2.95Å; L280-T283 PolarHBondContact O-N 2.96Å; L280-T283 VanDerWaalsContact O-N 3.07Å; L280-T283 PolarHBondContact O-OG1 2.67Å; L280-Y593 HydrophobicContact CD1-CD1 3.92Å; L280-Y593 HydrophobicContact CD1-CG 3.94Å; L280-Y593 HydrophobicContact CG-CD1 3.85Å; L280-Y593 HydrophobicContact CG-CE1 3.95Å; L280-Y593 HydrophobicContact CG-CG 4.16Å; L280-Y593 WeakPolarHBondContact O-CD1 3.39Å; L280-Y593 VanDerWaalsContact O-CE1 3.31Å; L280-Y593 WeakPolarHBondContact O-CE1 3.38Å
281	G	80.1	Confident	74.5	Confident	5 Å²	5	45.4 Å²	45.4	5%	0.052	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-53.6	-38	177.7	0	0	0	0	0	115	L205 V207 R279 T283 A284	L205-G281 PolarHBondContact O-N 2.94Å; V207-G281 CarbonylContact O-C 3.56Å; V207-G281 WeakPolarHBondContact O-CA 3.29Å; R279-G281 VanDerWaalsContact C-N 3.26Å; R279-G281 PolarHBondContact O-N 2.81Å; G281-T283 PolarHBondContact O-N 2.95Å; G281-A284 WeakPolarHBondContact O-CB 3.42Å; G281-A284 PolarHBondContact O-N 2.76Å
282	M	83.5	Confident	75.7	Confident	40 Å²	40	41.2 Å²	41.2	20%	0.197	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-69.7	-21.6	-178.7	-59.9	179.9	167.3	0	0	112.9	V207 E210 L244 Q278 R279 L280 A284	V207-M282 WeakPolarHBondContact O-CG 3.42Å; V207-M282 PolarHBondContact O-N 3.32Å; E210-M282 HydrophobicContact CB-CE 3.7Å; L244-M282 HydrophobicContact CB-CE 4.3Å; L244-M282 HydrophobicContact CD1-CE 4.28Å; L244-M282 HydrophobicContact CD1-SD 3.93Å; Q278-M282 HydrophobicContact CB-CB 4.23Å; Q278-M282 HydrophobicContact CB-SD 4.23Å; Q278-M282 HydrophobicContact CG-SD 4.47Å; R279-M282 HydrophobicContact CB-CG 4.3Å; R279-M282 HydrophobicContact CB-SD 4.38Å; R279-M282 WeakPolarHBondContact O-CB 3.28Å; R279-M282 PolarHBondContact O-N 3.13Å; L280-M282 VanDerWaalsContact C-N 3.29Å; L280-M282 PolarHBondContact O-N 2.95Å; M282-A284 VanDerWaalsContact C-N 3.3Å
283	T	82.5	Confident	76.3	Confident	18 Å²	18	36.7 Å²	36.7	11%	0.11	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-86.4	-6.7	179.2	73.3	0	0	0	0	112.4	Q278 L280 G281 S285 P594	Q278-T283 HydrophobicContact CB-CG2 4.21Å; L280-T283 PolarHBondContact O-N 2.96Å; L280-T283 VanDerWaalsContact O-N 3.07Å; L280-T283 PolarHBondContact O-OG1 2.67Å; G281-T283 PolarHBondContact O-N 2.95Å; T283-S285 PolarHBondContact O-N 2.64Å; T283-P594 WeakPolarHBondContact O-CD 3.32Å
284	A	85.1	Confident	76.6	Confident	32 Å²	32	32.2 Å²	32.2	26%	0.264	20%	0.196	S	C	.	.			trans	-63	132.1	-179	0	0	0	0	0	111	G281 M282 K591 L592 Y593	G281-A284 WeakPolarHBondContact O-CB 3.42Å; G281-A284 PolarHBondContact O-N 2.76Å; M282-A284 VanDerWaalsContact C-N 3.3Å; A284-K591 HydrophobicContact CB-CB 4.28Å; A284-L592 WeakPolarHBondContact CA-O 3.36Å; A284-Y593 HydrophobicContact CB-CD1 3.89Å; A284-Y593 HydrophobicContact CB-CE1 3.63Å
285	S	86.5	Confident	76.8	Confident	25 Å²	25	30.2 Å²	30.2	18%	0.175	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.1	172.8	-176.1	0	0	0	0	109	T283 M287 D308 K591 L592	T283-S285 PolarHBondContact O-N 2.64Å; S285-M287 PolarHBondContact O-N 2.96Å; S285-D308 PolarHBondContact OG-OD2 2.8Å; S285-D308 VanDerWaalsContact OG-OD2 3.04Å; S285-K591 WeakPolarHBondContact O-CA 3.28Å; S285-L592 PolarHBondContact N-O 3.47Å; S285-L592 PolarHBondContact O-N 2.79Å
286	E	89.7	Confident	76.3	Confident	56 Å²	56	36.8 Å²	36.8	26%	0.262	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	119.9	174.1	-168.6	-178.1	-164.3	0	0	108.9	F530 Q531 V589 K591	E286-F530 HydrophobicContact CB-CE2 3.93Å; E286-F530 HydrophobicContact CG-CD2 3.84Å; E286-F530 HydrophobicContact CG-CE2 3.72Å; E286-Q531 WeakPolarHBondContact OE2-CG 3.39Å; E286-Q531 PolarHBondContact OE2-N 2.8Å; E286-V589 HydrophobicContact CG-CG1 3.52Å; E286-V589 WeakPolarHBondContact OE1-CG1 3.19Å; E286-K591 HydrophobicContact CB-CG 4.49Å
287	M	91.1	Very high	75.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147.8	-174.1	-61.6	-173	-168.9	0	0	111.7	S285 C306 L307 D308 F315 V589 A590 L592 P594 L597	S285-M287 PolarHBondContact O-N 2.96Å; M287-C306 HydrophobicContact CB-CB 4.37Å; M287-C306 HydrophobicContact SD-CB 4.02Å; M287-L307 WeakPolarHBondContact CA-O 3.42Å; M287-D308 HydrophobicContact CE-CB 4.26Å; M287-D308 HydrophobicContact CG-CB 4.11Å; M287-D308 HydrophobicContact SD-CB 4.42Å; M287-F315 HydrophobicContact CE-CD2 3.61Å; M287-F315 HydrophobicContact CE-CE2 3.58Å; M287-F315 HydrophobicContact CE-CG 4.41Å; M287-F315 HydrophobicContact CE-CZ 4.36Å; M287-F315 HydrophobicContact SD-CD2 3.66Å; M287-F315 HydrophobicContact SD-CE2 4.21Å; M287-F315 HydrophobicContact SD-CG 4.41Å; M287-V589 WeakPolarHBondContact O-CA 3.41Å; M287-A590 PolarHBondContact N-O 2.62Å; M287-A590 PolarHBondContact O-N 2.82Å; M287-L592 HydrophobicContact CB-CD1 4.33Å; M287-L592 HydrophobicContact SD-CB 4.11Å; M287-L592 HydrophobicContact SD-CD1 4.21Å; M287-P594 HydrophobicContact CE-CB 4.33Å; M287-P594 HydrophobicContact CE-CG 3.7Å; M287-L597 HydrophobicContact CE-CD1 4.47Å; M287-L597 HydrophobicContact SD-CD1 4.1Å
288	I	90.8	Very high	73.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	114.6	167.8	-58.2	-174.6	0	0	0	108.7	C306 L307 I309 V528 F537 L558 C587 V589	I288-C306 CarbonylContact O-C 3.57Å; I288-C306 WeakPolarHBondContact O-CA 3.39Å; I288-L307 PolarHBondContact N-O 3.5Å; I288-L307 PolarHBondContact O-N 3.36Å; I288-I309 HydrophobicContact CD1-CD1 3.61Å; I288-I309 HydrophobicContact CD1-CG1 4.38Å; I288-I309 HydrophobicContact CG1-CD1 3.9Å; I288-V528 HydrophobicContact CD1-CG2 4.06Å; I288-F537 HydrophobicContact CD1-CD2 4.31Å; I288-F537 HydrophobicContact CG2-CD2 4.37Å; I288-L558 HydrophobicContact CD1-CD1 3.74Å; I288-L558 HydrophobicContact CD1-CD2 4.07Å; I288-C587 HydrophobicContact CG2-CB 4.25Å; I288-V589 HydrophobicContact CG1-CG2 4.16Å
289	I	90.6	Very high	71.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.4	175.6	-50	177.3	0	0	0	108.5	F291 V304 L317 I337 C587 A588 A590 L592	I289-F291 HydrophobicContact CB-CE2 4.07Å; I289-F291 HydrophobicContact CG2-CD2 3.91Å; I289-F291 HydrophobicContact CG2-CE2 3.42Å; I289-F291 VanDerWaalsContact CG2-CE2 3.42Å; I289-F291 HydrophobicContact CG2-CZ 3.84Å; I289-V304 HydrophobicContact CG2-CG1 3.45Å; I289-V304 VanDerWaalsContact CG2-CG1 3.45Å; I289-L317 HydrophobicContact CD1-CD1 4.17Å; I289-L317 HydrophobicContact CG2-CD1 4.29Å; I289-I337 HydrophobicContact CD1-CD1 3.49Å; I289-I337 VanDerWaalsContact CD1-CD1 3.49Å; I289-C587 CarbonylContact O-C 3.57Å; I289-C587 VanDerWaalsContact O-CA 3.26Å; I289-C587 WeakPolarHBondContact O-CA 3.47Å; I289-A588 PolarHBondContact N-O 2.57Å; I289-A588 PolarHBondContact O-N 3.47Å; I289-A590 HydrophobicContact CD1-CB 3.96Å; I289-L592 HydrophobicContact CD1-CD1 3.77Å; I289-L592 HydrophobicContact CD1-CD2 4.14Å; I289-L592 HydrophobicContact CD1-CG 4.17Å; I289-L592 HydrophobicContact CG1-CD1 3.85Å
290	C	87.6	Confident	69.6	Low	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	103	-179.6	-61.8	0	0	0	0	111.6	V304 P305 W579 L581 E586 C587	C290-V304 WeakPolarHBondContact O-CG1 3.44Å; C290-P305 HydrophobicContact CB-CG 4.33Å; C290-P305 PolarHBondContact N-O 3.37Å; C290-P305 WeakPolarHBondContact O-CD 3.25Å; C290-W579 HydrophobicContact CB-CH2 3.78Å; C290-W579 HydrophobicContact CB-CZ3 3.46Å; C290-W579 VanDerWaalsContact CB-CZ3 3.46Å; C290-W579 WeakPolarHBondContact SG-CH2 3.13Å; C290-L581 HydrophobicContact CB-CD2 3.93Å; C290-E586 CarbonylContact C-O 3.57Å; C290-E586 WeakPolarHBondContact CA-O 3.27Å; C290-C587 PolarHBondContact SG-SG 3.48Å
291	F	81.4	Confident	68	Low	5 Å²	5	59.9 Å²	59.9	2%	0.022	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	157.2	178.7	-69.2	-93.1	0	0	0	111.7	I289 V304 P320 I329 I337 I339 W370 F585 E586 A588	I289-F291 HydrophobicContact CB-CE2 4.07Å; I289-F291 HydrophobicContact CG2-CD2 3.91Å; I289-F291 HydrophobicContact CG2-CE2 3.42Å; I289-F291 VanDerWaalsContact CG2-CE2 3.42Å; I289-F291 HydrophobicContact CG2-CZ 3.84Å; F291-V304 HydrophobicContact CD1-CG1 4.27Å; F291-V304 HydrophobicContact CD1-CG2 4.33Å; F291-V304 HydrophobicContact CE1-CG1 4.45Å; F291-V304 HydrophobicContact CG-CG1 4.39Å; F291-P320 HydrophobicContact CD1-CG 4.16Å; F291-P320 HydrophobicContact CE1-CG 4.47Å; F291-I329 HydrophobicContact CB-CD1 3.85Å; F291-I329 HydrophobicContact CD1-CD1 4.45Å; F291-I329 HydrophobicContact CD2-CD1 3.41Å; F291-I329 VanDerWaalsContact CD2-CD1 3.41Å; F291-I329 HydrophobicContact CD2-CG1 4.24Å; F291-I329 HydrophobicContact CD2-CG2 4.48Å; F291-I329 HydrophobicContact CE2-CD1 4.03Å; F291-I329 HydrophobicContact CE2-CG1 4.43Å; F291-I329 HydrophobicContact CE2-CG2 4Å; F291-I329 HydrophobicContact CG-CD1 3.65Å; F291-I329 HydrophobicContact CG-CG1 4.44Å; F291-I329 HydrophobicContact CZ-CG2 4.47Å; F291-I337 HydrophobicContact CZ-CG2 4.24Å; F291-I339 HydrophobicContact CE1-CG2 4.12Å; F291-I339 HydrophobicContact CZ-CG2 4.43Å; F291-W370 AromaticContact CE1-CH2 3.89Å; F291-W370 HydrophobicContact CE1-CH2 3.89Å; F291-W370 AromaticContact CE1-CZ2 3.75Å; F291-W370 HydrophobicContact CE1-CZ2 3.75Å; F291-W370 HydrophobicContact CZ-CH2 4.08Å; F291-W370 HydrophobicContact CZ-CZ2 4.22Å; F291-F585 WeakPolarHBondContact O-CA 3.4Å; F291-F585 VanDerWaalsContact O-CB 3.25Å; F291-F585 WeakPolarHBondContact O-CB 3.22Å; F291-E586 PolarHBondContact N-O 2.95Å; F291-E586 PolarHBondContact O-N 2.92Å; F291-A588 HydrophobicContact CE2-CB 4.23Å
292	D	67.9	Low	67	Low	21 Å²	21	62.5 Å²	62.5	11%	0.112	33%	0.334	C	S	.	.			trans	59.1	50.6	178	-161.1	14.2	0	0	0	114.6	A294 R325	D292-A294 PolarHBondContact O-N 3.27Å; D292-A294 VanDerWaalsContact O-N 3.09Å; D292-R325 IonicContact OD1-NH1 3.3Å
293	A	53.5	Low	66.3	Low	18 Å²	18	62.2 Å²	62.2	15%	0.149	33%	0.334	C	S	.	.			trans	-66.9	101.2	161.4	0	0	0	0	0	109	Q302 L581	A293-Q302 PolarHBondContact O-NE2 3.47Å; A293-L581 HydrophobicContact CB-CD2 4.25Å
294	A	49.2	Very low	66.3	Low	30 Å²	30	61.6 Å²	61.6	25%	0.248	33%	0.331	C	S	.	.			trans	-68.1	142.6	-178.2	0	0	0	0	0	111.8	D292 G582	D292-A294 PolarHBondContact O-N 3.27Å; D292-A294 VanDerWaalsContact O-N 3.09Å; A294-G582 VanDerWaalsContact CB-CA 3.49Å
295	H	50.4	Low	66.3	Low	105 Å²	105	60.5 Å²	60.5	49%	0.486	32%	0.32	S	S	.	.			trans	-136.7	122.3	149.2	-140	45.4	0	0	0	112.3	S298	H295-S298 VanDerWaalsContact CD2-CB 3.41Å; H295-S298 WeakPolarHBondContact CD2-CB 3.47Å; H295-S298 PolarHBondContact CD2-N 3.19Å; H295-S298 PolarHBondContact CD2-OG 3.36Å
296	K	41.1	Very low	66.3	Low	183 Å²	183	59.3 Å²	59.3	80%	0.796	31%	0.312	S	S	*	.	S	Bend	trans	-83.7	-12.2	171.1	-84.3	-170.3	170.2	-165.9	0	112.9
297	H	38.1	Very low	66.2	Low	180 Å²	180	56.6 Å²	56.6	83%	0.833	30%	0.3	S	S	*	.	S	Bend	trans	-144.7	28.3	-167.9	-79.1	-31.9	0	0	0	118.4
298	S	41.3	Very low	66	Low	65 Å²	65	56.9 Å²	56.9	46%	0.455	30%	0.301	S	S	.	.			trans	-147.2	124.8	164.4	107.2	0	0	0	0	112.3	H295 K300	H295-S298 VanDerWaalsContact CD2-CB 3.41Å; H295-S298 WeakPolarHBondContact CD2-CB 3.47Å; H295-S298 PolarHBondContact CD2-N 3.19Å; H295-S298 PolarHBondContact CD2-OG 3.36Å; S298-K300 PolarHBondContact O-N 3.15Å
299	G	42.1	Very low	65.6	Low	93 Å²	93	58.4 Å²	58.4	96%	0.959	31%	0.309	S	S	*	.			trans	-73.2	41.3	175.9	0	0	0	0	0	113.7
300	K	47.5	Very low	65.2	Low	182 Å²	182	63.4 Å²	63.4	79%	0.791	34%	0.339	S	S	*	.	S	Bend	trans	-119.4	140.5	174.1	-75.6	-173.2	178.5	179.4	0	111.7	S298 Q302	S298-K300 PolarHBondContact O-N 3.15Å; K300-Q302 PolarHBondContact O-N 2.93Å
301	K	49.1	Very low	64.9	Low	199 Å²	199	66.8 Å²	66.8	87%	0.865	36%	0.36	S	S	*	.			trans	-32.2	107.7	-174.7	-64.7	174.3	178.2	179.5	0	113.9
302	Q	58.7	Low	64.9	Low	61 Å²	61	68 Å²	68	29%	0.285	37%	0.374	S	S	.	.			trans	-62.4	134.9	168.9	-165.2	173	-5.6	0	0	109.4	A293 K300 D323	A293-Q302 PolarHBondContact O-NE2 3.47Å; K300-Q302 PolarHBondContact O-N 2.93Å; Q302-D323 PolarHBondContact NE2-OD1 3.28Å; Q302-D323 PolarHBondContact OE1-OD1 3Å
303	T	68.4	Low	65.6	Low	33 Å²	33	73 Å²	73	20%	0.202	40%	0.395	C	S	.	.			trans	-138	151.3	177.8	45.2	0	0	0	0	107.8	P305 K316	T303-P305 WeakPolarHBondContact O-CD 3.44Å; T303-K316 HydrophobicContact CG2-CB 4.24Å; T303-K316 HydrophobicContact CG2-CD 4.01Å; T303-K316 HydrophobicContact CG2-CG 4.19Å; T303-K316 WeakPolarHBondContact OG1-CD 3.33Å; T303-K316 WeakPolarHBondContact OG1-CE 3.4Å; T303-K316 VanDerWaalsContact OG1-CG 3.27Å; T303-K316 WeakPolarHBondContact OG1-CG 3.46Å
304	V	81.8	Confident	67	Low	6 Å²	6	72.7 Å²	72.7	4%	0.036	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	113.5	-179.9	177.5	0	0	0	0	107.8	I289 C290 F291 L317 P320	I289-V304 HydrophobicContact CG2-CG1 3.45Å; I289-V304 VanDerWaalsContact CG2-CG1 3.45Å; C290-V304 WeakPolarHBondContact O-CG1 3.44Å; F291-V304 HydrophobicContact CD1-CG1 4.27Å; F291-V304 HydrophobicContact CD1-CG2 4.33Å; F291-V304 HydrophobicContact CE1-CG1 4.45Å; F291-V304 HydrophobicContact CG-CG1 4.39Å; V304-L317 HydrophobicContact CB-CB 4.07Å; V304-L317 HydrophobicContact CB-CD2 4.27Å; V304-L317 HydrophobicContact CG1-CB 4.48Å; V304-L317 PolarHBondContact N-O 3.05Å; V304-L317 PolarHBondContact O-N 3.36Å; V304-P320 HydrophobicContact CG2-CG 4.29Å
305	P	85.4	Confident	68.8	Low	8 Å²	8	71.8 Å²	71.8	5%	0.052	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	134.2	178.8	24.8	-30.3	0	0	0	111.2	C290 T303 V314 F315 W579	C290-P305 HydrophobicContact CB-CG 4.33Å; C290-P305 PolarHBondContact N-O 3.37Å; C290-P305 WeakPolarHBondContact O-CD 3.25Å; T303-P305 WeakPolarHBondContact O-CD 3.44Å; P305-V314 HydrophobicContact CB-CG1 4.28Å; P305-F315 WeakPolarHBondContact CA-O 3.36Å; P305-W579 HydrophobicContact CB-CB 4.48Å; P305-W579 HydrophobicContact CB-CD2 3.73Å; P305-W579 HydrophobicContact CB-CE3 3.6Å; P305-W579 HydrophobicContact CB-CG 4.1Å; P305-W579 HydrophobicContact CB-CH2 4.47Å; P305-W579 HydrophobicContact CB-CZ3 3.93Å; P305-W579 HydrophobicContact CG-CD2 3.76Å; P305-W579 HydrophobicContact CG-CE3 3.09Å; P305-W579 HydrophobicContact CG-CG 4.36Å; P305-W579 HydrophobicContact CG-CH2 4.29Å; P305-W579 HydrophobicContact CG-CZ3 3.35Å
306	C	87.4	Confident	70.4	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.9	173.4	-54.5	0	0	0	0	108.8	M287 I288 V314 F315 L317 L592	M287-C306 HydrophobicContact CB-CB 4.37Å; M287-C306 HydrophobicContact SD-CB 4.02Å; I288-C306 CarbonylContact O-C 3.57Å; I288-C306 WeakPolarHBondContact O-CA 3.39Å; C306-V314 CarbonylContact O-C 3.51Å; C306-V314 WeakPolarHBondContact O-CA 3.43Å; C306-F315 HydrophobicContact CB-CB 4.32Å; C306-F315 PolarHBondContact N-O 2.88Å; C306-F315 PolarHBondContact O-N 2.97Å; C306-L317 VanDerWaalsContact SG-CB 3.58Å; C306-L592 HydrophobicContact CB-CD1 3.93Å; C306-L592 VanDerWaalsContact SG-CD1 3.52Å
307	L	86.4	Confident	72.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.1	179.3	174.9	66.1	0	0	0	109.8	M287 I288 I309 V314 F537 Y572	M287-L307 WeakPolarHBondContact CA-O 3.42Å; I288-L307 PolarHBondContact N-O 3.5Å; I288-L307 PolarHBondContact O-N 3.36Å; L307-I309 HydrophobicContact CD2-CG1 4.25Å; L307-I309 HydrophobicContact CG-CG1 4.31Å; L307-V314 HydrophobicContact CD1-CG2 3.96Å; L307-F537 HydrophobicContact CD2-CE2 4.48Å; L307-Y572 HydrophobicContact CD1-CE1 4.02Å; L307-Y572 HydrophobicContact CD2-CD1 3.93Å; L307-Y572 HydrophobicContact CD2-CE1 3.57Å; L307-Y572 HydrophobicContact CG-CE1 4.42Å
308	D	86.9	Confident	74.8	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.032	31%	0.305	C	S	.	.			trans	-87.6	112.8	162.1	-179.5	-18.4	0	0	0	108.2	S285 M287 V310 T311 G312 K313 F315	S285-D308 PolarHBondContact OG-OD2 2.8Å; S285-D308 VanDerWaalsContact OG-OD2 3.04Å; M287-D308 HydrophobicContact CE-CB 4.26Å; M287-D308 HydrophobicContact CG-CB 4.11Å; M287-D308 HydrophobicContact SD-CB 4.42Å; D308-V310 WeakPolarHBondContact OD1-CB 3.27Å; D308-V310 PolarHBondContact OD1-N 3.43Å; D308-T311 WeakPolarHBondContact CB-OG1 3.23Å; D308-T311 PolarHBondContact OD1-N 2.98Å; D308-T311 VanDerWaalsContact OD1-N 3.08Å; D308-T311 WeakPolarHBondContact OD2-CG2 3.34Å; D308-T311 PolarHBondContact OD2-OG1 2.96Å; D308-G312 CarbonylContact O-C 3.6Å; D308-G312 WeakPolarHBondContact O-CA 3.46Å; D308-G312 PolarHBondContact O-N 3.45Å; D308-K313 PolarHBondContact N-O 3.46Å; D308-K313 PolarHBondContact O-N 2.91Å; D308-F315 HydrophobicContact CB-CE2 4.16Å
309	I	82.1	Confident	76.7	Confident	31 Å²	31	57 Å²	57	16%	0.159	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-33.5	-177.4	-61.8	156.1	0	0	0	111.1	I288 L307 F530 L558	I288-I309 HydrophobicContact CD1-CD1 3.61Å; I288-I309 HydrophobicContact CD1-CG1 4.38Å; I288-I309 HydrophobicContact CG1-CD1 3.9Å; L307-I309 HydrophobicContact CD2-CG1 4.25Å; L307-I309 HydrophobicContact CG-CG1 4.31Å; I309-F530 HydrophobicContact CB-CE1 4.27Å; I309-F530 HydrophobicContact CB-CZ 4.17Å; I309-F530 HydrophobicContact CD1-CD1 3.71Å; I309-F530 HydrophobicContact CD1-CD2 4.09Å; I309-F530 HydrophobicContact CD1-CE1 3.56Å; I309-F530 HydrophobicContact CD1-CE2 3.95Å; I309-F530 HydrophobicContact CD1-CG 3.98Å; I309-F530 HydrophobicContact CD1-CZ 3.69Å; I309-F530 HydrophobicContact CG1-CZ 4.46Å; I309-L558 HydrophobicContact CD1-CD2 3.36Å; I309-L558 HydrophobicContact CG1-CD2 3.94Å; I309-L558 HydrophobicContact CG2-CD2 4.42Å
310	V	82.4	Confident	78.7	Confident	105 Å²	105	53.1 Å²	53.1	64%	0.636	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-44.2	-176	-178.8	0	0	0	0	109.8	D308	D308-V310 WeakPolarHBondContact OD1-CB 3.27Å; D308-V310 PolarHBondContact OD1-N 3.43Å
311	T	82.6	Confident	80.5	Confident	72 Å²	72	45.5 Å²	45.5	44%	0.442	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-14.5	179.6	66.3	0	0	0	0	113.5	D308 K313	D308-T311 WeakPolarHBondContact CB-OG1 3.23Å; D308-T311 PolarHBondContact OD1-N 2.98Å; D308-T311 VanDerWaalsContact OD1-N 3.08Å; D308-T311 WeakPolarHBondContact OD2-CG2 3.34Å; D308-T311 PolarHBondContact OD2-OG1 2.96Å; T311-K313 PolarHBondContact O-N 3.09Å; T311-K313 WeakPolarHBondContact OG1-CB 3.42Å; T311-K313 PolarHBondContact OG1-N 2.99Å
312	G	79.7	Confident	81.9	Confident	31 Å²	31	40 Å²	40	32%	0.32	22%	0.216	S	C	.	.			trans	67.9	6.9	-172.7	0	0	0	0	0	114	D308	D308-G312 CarbonylContact O-C 3.6Å; D308-G312 WeakPolarHBondContact O-CA 3.46Å; D308-G312 PolarHBondContact O-N 3.45Å
313	K	83.3	Confident	82.7	Confident	125 Å²	125	39 Å²	39	54%	0.543	21%	0.212	S	C	.	.			trans	-83.8	148.1	-177.4	-66.7	179.5	-179.2	173.6	0	111	D308 T311 F315	D308-K313 PolarHBondContact N-O 3.46Å; D308-K313 PolarHBondContact O-N 2.91Å; T311-K313 PolarHBondContact O-N 3.09Å; T311-K313 WeakPolarHBondContact OG1-CB 3.42Å; T311-K313 PolarHBondContact OG1-N 2.99Å; K313-F315 HydrophobicContact CB-CE2 3.86Å; K313-F315 HydrophobicContact CB-CZ 4.09Å; K313-F315 HydrophobicContact CD-CZ 4.47Å
314	V	83.6	Confident	83.4	Confident	11 Å²	11	37.9 Å²	37.9	7%	0.067	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.8	177.9	-177.3	0	0	0	0	109.5	P305 C306 L307 L578 V600	P305-V314 HydrophobicContact CB-CG1 4.28Å; C306-V314 CarbonylContact O-C 3.51Å; C306-V314 WeakPolarHBondContact O-CA 3.43Å; L307-V314 HydrophobicContact CD1-CG2 3.96Å; V314-L578 HydrophobicContact CB-CD2 4.47Å; V314-L578 HydrophobicContact CG2-CD2 4.11Å; V314-V600 HydrophobicContact CG1-CG2 4.3Å; V314-V600 WeakPolarHBondContact O-CG2 3.43Å
315	F	86.3	Confident	83.4	Confident	12 Å²	12	39.6 Å²	39.6	5%	0.053	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	163.5	177.4	-59.3	-88.4	0	0	0	110.6	M287 P305 C306 D308 K313 P594 L597 K599	M287-F315 HydrophobicContact CE-CD2 3.61Å; M287-F315 HydrophobicContact CE-CE2 3.58Å; M287-F315 HydrophobicContact CE-CG 4.41Å; M287-F315 HydrophobicContact CE-CZ 4.36Å; M287-F315 HydrophobicContact SD-CD2 3.66Å; M287-F315 HydrophobicContact SD-CE2 4.21Å; M287-F315 HydrophobicContact SD-CG 4.41Å; P305-F315 WeakPolarHBondContact CA-O 3.36Å; C306-F315 HydrophobicContact CB-CB 4.32Å; C306-F315 PolarHBondContact N-O 2.88Å; C306-F315 PolarHBondContact O-N 2.97Å; D308-F315 HydrophobicContact CB-CE2 4.16Å; K313-F315 HydrophobicContact CB-CE2 3.86Å; K313-F315 HydrophobicContact CB-CZ 4.09Å; K313-F315 HydrophobicContact CD-CZ 4.47Å; F315-P594 HydrophobicContact CD1-CB 4.5Å; F315-P594 HydrophobicContact CE1-CB 3.76Å; F315-P594 HydrophobicContact CE2-CB 4.48Å; F315-P594 HydrophobicContact CZ-CB 3.75Å; F315-P594 HydrophobicContact CZ-CG 4.44Å; F315-L597 HydrophobicContact CB-CB 3.94Å; F315-L597 HydrophobicContact CB-CD1 3.56Å; F315-L597 HydrophobicContact CB-CG 4.41Å; F315-L597 HydrophobicContact CD1-CB 4.21Å; F315-L597 HydrophobicContact CG-CB 4.4Å; F315-L597 HydrophobicContact CG-CD1 4.02Å; F315-K599 HydrophobicContact CD1-CG 4.33Å; F315-K599 HydrophobicContact CE1-CG 4.23Å
316	K	84.9	Confident	83.3	Confident	66 Å²	66	40.9 Å²	40.9	29%	0.287	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.3	175.2	-84.9	165.8	-171.9	172.7	0	110.8	T303 Q598 V600	T303-K316 HydrophobicContact CG2-CB 4.24Å; T303-K316 HydrophobicContact CG2-CD 4.01Å; T303-K316 HydrophobicContact CG2-CG 4.19Å; T303-K316 WeakPolarHBondContact OG1-CD 3.33Å; T303-K316 WeakPolarHBondContact OG1-CE 3.4Å; T303-K316 VanDerWaalsContact OG1-CG 3.27Å; T303-K316 WeakPolarHBondContact OG1-CG 3.46Å; K316-Q598 HydrophobicContact CB-CB 3.99Å; K316-Q598 PolarHBondContact N-O 2.86Å; K316-Q598 PolarHBondContact O-N 3.24Å; K316-Q598 VanDerWaalsContact O-N 3.17Å; K316-V600 HydrophobicContact CB-CG2 4.06Å; K316-V600 HydrophobicContact CD-CB 4.42Å; K316-V600 HydrophobicContact CD-CG1 4.46Å; K316-V600 HydrophobicContact CD-CG2 3.47Å; K316-V600 VanDerWaalsContact CD-CG2 3.47Å; K316-V600 VanDerWaalsContact CE-CG2 3.42Å; K316-V600 HydrophobicContact CG-CG2 3.32Å
317	L	86.7	Confident	83.4	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	147.3	166.6	-171.3	157.8	0	0	0	109.3	I289 V304 C306 Y363 W370 L592 L597	I289-L317 HydrophobicContact CD1-CD1 4.17Å; I289-L317 HydrophobicContact CG2-CD1 4.29Å; V304-L317 HydrophobicContact CB-CB 4.07Å; V304-L317 HydrophobicContact CB-CD2 4.27Å; V304-L317 HydrophobicContact CG1-CB 4.48Å; V304-L317 PolarHBondContact N-O 3.05Å; V304-L317 PolarHBondContact O-N 3.36Å; C306-L317 VanDerWaalsContact SG-CB 3.58Å; L317-Y363 HydrophobicContact CD1-CD1 4.4Å; L317-Y363 HydrophobicContact CD1-CD2 4.39Å; L317-Y363 HydrophobicContact CD1-CE1 3.93Å; L317-Y363 HydrophobicContact CD1-CE2 3.94Å; L317-Y363 HydrophobicContact CD2-CD2 3.88Å; L317-Y363 HydrophobicContact CD2-CE2 3.52Å; L317-Y363 HydrophobicContact CG-CD2 4.26Å; L317-Y363 HydrophobicContact CG-CE1 4.33Å; L317-Y363 HydrophobicContact CG-CE2 3.53Å; L317-W370 HydrophobicContact CD2-CZ2 3.97Å; L317-L592 HydrophobicContact CD1-CD1 4.17Å; L317-L592 HydrophobicContact CD1-CD2 4.41Å; L317-L597 HydrophobicContact CB-CD2 4.23Å
318	C	85	Confident	83.6	Confident	31 Å²	31	41.6 Å²	41.6	21%	0.209	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-59.6	149.1	180	70.5	0	0	0	0	111.8	N368 W370	C318-N368 VanDerWaalsContact CB-O 3.24Å; C318-N368 WeakPolarHBondContact CB-O 3.16Å; C318-N368 WeakPolarHBondContact CB-OD1 3.47Å; C318-N368 PolarHBondContact N-OD1 2.92Å; C318-N368 VanDerWaalsContact SG-C 3.58Å; C318-N368 PolarHBondContact SG-O 3Å; C318-W370 PolarHBondContact O-NE1 3.09Å; C318-W370 PolarHBondContact SG-NE1 3.12Å; C318-W370 VanDerWaalsContact SG-NE1 3.43Å
319	K	81.3	Confident	83.9	Confident	123 Å²	123	43 Å²	43	54%	0.535	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-62.5	145.6	-179.5	60.6	176	-174.7	168.5	0	111.2	W370	K319-W370 VanDerWaalsContact O-CD1 3.22Å; K319-W370 PolarHBondContact O-NE1 3.34Å
320	P	84	Confident	84.6	Confident	12 Å²	12	42.4 Å²	42.4	8%	0.078	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-51.7	143.9	165.2	-25.9	35.7	0	0	0	110.2	F291 V304 I339	F291-P320 HydrophobicContact CD1-CG 4.16Å; F291-P320 HydrophobicContact CE1-CG 4.47Å; V304-P320 HydrophobicContact CG2-CG 4.29Å; P320-I339 HydrophobicContact CB-CD1 3.92Å
321	P	83.9	Confident	85.1	Confident	23 Å²	23	39.2 Å²	39.2	15%	0.149	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-56.9	151	175.3	-27.4	40.6	0	0	0	110.5	D323 L324 W361 W370	P321-D323 PolarHBondContact O-N 3.39Å; P321-L324 WeakPolarHBondContact O-CG 3.35Å; P321-L324 PolarHBondContact O-N 2.99Å; P321-W361 HydrophobicContact CB-CD2 4.04Å; P321-W361 HydrophobicContact CB-CE3 4.27Å; P321-W361 HydrophobicContact CB-CH2 3.87Å; P321-W361 HydrophobicContact CB-CZ2 3.57Å; P321-W361 HydrophobicContact CB-CZ3 4.19Å; P321-W361 HydrophobicContact CG-CD2 3.54Å; P321-W361 HydrophobicContact CG-CE3 3.59Å; P321-W361 HydrophobicContact CG-CG 4.08Å; P321-W361 HydrophobicContact CG-CH2 4.05Å; P321-W361 HydrophobicContact CG-CZ2 3.98Å; P321-W361 HydrophobicContact CG-CZ3 3.84Å; P321-W370 HydrophobicContact CG-CB 3.45Å; P321-W370 VanDerWaalsContact CG-CB 3.45Å; P321-W370 HydrophobicContact CG-CG 3.86Å
322	N	78.5	Confident	85.6	Confident	83 Å²	83	36.2 Å²	36.2	44%	0.444	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	59.1	12.9	172.8	-60.1	-28.5	0	0	0	116.9	L324 D359	N322-L324 HydrophobicContact CB-CG 4.24Å; N322-L324 PolarHBondContact O-N 3.07Å; N322-D359 PolarHBondContact ND2-OD2 3.01Å
323	D	77	Confident	86	Confident	39 Å²	39	39.4 Å²	39.4	21%	0.209	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	52.2	40.8	-171.8	-166.8	36.8	0	0	0	112.8	Q302 P321 R325 P345	Q302-D323 PolarHBondContact NE2-OD1 3.28Å; Q302-D323 PolarHBondContact OE1-OD1 3Å; P321-D323 PolarHBondContact O-N 3.39Å; D323-R325 IonicContact OD1-NH2 2.74Å; D323-R325 IonicContact OD2-CZ 3.5Å; D323-R325 IonicContact OD2-NE 3.12Å; D323-R325 IonicContact OD2-NH2 2.57Å; D323-R325 PolarHBondContact OD2-NH2 3.23Å; D323-P345 WeakPolarHBondContact O-CD 3.43Å
324	L	81.3	Confident	86.1	Confident	10 Å²	10	37 Å²	37	5%	0.052	20%	0.196	C	C	.	.			trans	-61	134.3	176.7	-68.9	168	0	0	0	111.2	P321 N322 V327 E357 D359	P321-L324 WeakPolarHBondContact O-CG 3.35Å; P321-L324 PolarHBondContact O-N 2.99Å; N322-L324 HydrophobicContact CB-CG 4.24Å; N322-L324 PolarHBondContact O-N 3.07Å; L324-V327 HydrophobicContact CB-CG1 3.55Å; L324-E357 HydrophobicContact CD2-CB 3.85Å; L324-E357 HydrophobicContact CD2-CG 3.73Å; L324-D359 HydrophobicContact CD1-CB 3.93Å
325	R	82.2	Confident	86.3	Confident	43 Å²	43	37.9 Å²	37.9	16%	0.162	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-122.7	156.9	177.4	-57.3	-173.1	-169.7	-133.9	0.4	111.6	D292 D323 V327 G342 Y343	D292-R325 IonicContact OD1-NH1 3.3Å; D323-R325 IonicContact OD1-NH2 2.74Å; D323-R325 IonicContact OD2-CZ 3.5Å; D323-R325 IonicContact OD2-NE 3.12Å; D323-R325 IonicContact OD2-NH2 2.57Å; D323-R325 PolarHBondContact OD2-NH2 3.23Å; R325-V327 PolarHBondContact O-N 2.76Å; R325-G342 CarbonylContact O-C 3.59Å; R325-G342 WeakPolarHBondContact O-CA 3.41Å; R325-Y343 HydrophobicContact CB-CD1 4.15Å; R325-Y343 HydrophobicContact CB-CE1 3.64Å; R325-Y343 HydrophobicContact CB-CE2 4.37Å; R325-Y343 PolarHBondContact N-O 3.29Å; R325-Y343 WeakPolarHBondContact O-CD1 3.34Å; R325-Y343 PolarHBondContact O-N 3.08Å
326	E	83.5	Confident	86.5	Confident	34 Å²	34	38.4 Å²	38.4	16%	0.159	20%	0.204	C	C	.	.	S	Bend	trans	49.9	40.9	-174.9	-66.1	-175.3	-153.5	0	0	112.8	Y343 I381 G382 R398 H584	E326-Y343 HydrophobicContact CB-CD1 4.17Å; E326-Y343 HydrophobicContact CB-CE1 4.03Å; E326-Y343 HydrophobicContact CG-CD1 4.49Å; E326-Y343 HydrophobicContact CG-CE1 3.87Å; E326-I381 HydrophobicContact CB-CG2 3.9Å; E326-G382 WeakPolarHBondContact O-CA 3.46Å; E326-G382 PolarHBondContact O-N 3.26Å; E326-R398 IonicContact OE1-NH2 2.83Å; E326-R398 PolarHBondContact OE1-NH2 3.18Å; E326-R398 IonicContact OE2-CZ 3.56Å; E326-R398 IonicContact OE2-NH1 2.78Å; E326-R398 IonicContact OE2-NH2 3.58Å; E326-R398 PolarHBondContact OE2-NH2 3.2Å; E326-H584 HydrophobicContact CG-CB 4.48Å; E326-H584 IonicContact OE1-ND1 3.97Å
327	V	89.4	Confident	87	Confident	14 Å²	14	35.3 Å²	35.3	9%	0.085	19%	0.19	C	C	.	.			trans	-71.6	147.4	174.8	-59.5	0	0	0	0	110.3	L324 R325 I329 I339	L324-V327 HydrophobicContact CB-CG1 3.55Å; R325-V327 PolarHBondContact O-N 2.76Å; V327-I329 HydrophobicContact CG2-CD1 4.42Å; V327-I329 HydrophobicContact CG2-CG1 3.87Å; V327-I339 HydrophobicContact CB-CB 4.27Å; V327-I339 HydrophobicContact CG2-CB 4.06Å; V327-I339 HydrophobicContact CG2-CG2 4Å
328	G	91.6	Very high	87.4	Confident	2 Å²	2	36.3 Å²	36.3	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.8	162.9	0	0	0	0	0	108.8	I339 A340 C383 L385	G328-I339 CarbonylContact O-C 3.44Å; G328-I339 VanDerWaalsContact O-CA 3.23Å; G328-I339 WeakPolarHBondContact O-CA 3.39Å; G328-A340 PolarHBondContact N-O 3.48Å; G328-A340 PolarHBondContact O-N 3.36Å; G328-C383 VanDerWaalsContact CA-O 3.28Å; G328-C383 WeakPolarHBondContact CA-O 3.39Å; G328-L385 WeakPolarHBondContact O-CD1 3.33Å
329	I	93.8	Very high	87.8	Confident	34 Å²	34	34.9 Å²	34.9	17%	0.174	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.5	-179.1	-56.5	157.4	0	0	0	108.4	F291 V327 Y338 I339 E586 A588	F291-I329 HydrophobicContact CB-CD1 3.85Å; F291-I329 HydrophobicContact CD1-CD1 4.45Å; F291-I329 HydrophobicContact CD2-CD1 3.41Å; F291-I329 VanDerWaalsContact CD2-CD1 3.41Å; F291-I329 HydrophobicContact CD2-CG1 4.24Å; F291-I329 HydrophobicContact CD2-CG2 4.48Å; F291-I329 HydrophobicContact CE2-CD1 4.03Å; F291-I329 HydrophobicContact CE2-CG1 4.43Å; F291-I329 HydrophobicContact CE2-CG2 4Å; F291-I329 HydrophobicContact CG-CD1 3.65Å; F291-I329 HydrophobicContact CG-CG1 4.44Å; F291-I329 HydrophobicContact CZ-CG2 4.47Å; V327-I329 HydrophobicContact CG2-CD1 4.42Å; V327-I329 HydrophobicContact CG2-CG1 3.87Å; I329-Y338 WeakPolarHBondContact CA-O 3.26Å; I329-I339 HydrophobicContact CG1-CG2 4.19Å; I329-E586 HydrophobicContact CD1-CB 3.53Å; I329-E586 HydrophobicContact CD1-CG 4.37Å; I329-A588 HydrophobicContact CG2-CB 3.79Å
330	L	95.1	Very high	88.4	Confident	19 Å²	19	29 Å²	29	10%	0.099	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.8	172.9	179.8	64.9	0	0	0	109.7	I337 Y338 L385 M392	L330-I337 WeakPolarHBondContact O-CA 3.26Å; L330-Y338 PolarHBondContact N-O 3.42Å; L330-Y338 PolarHBondContact O-N 2.7Å; L330-L385 HydrophobicContact CB-CB 3.64Å; L330-L385 HydrophobicContact CB-CD1 4.08Å; L330-L385 HydrophobicContact CD2-CB 4.41Å; L330-L385 HydrophobicContact CG-CB 4.49Å; L330-M392 HydrophobicContact CB-CE 4.48Å; L330-M392 HydrophobicContact CD2-CB 4.22Å; L330-M392 HydrophobicContact CD2-CE 3.45Å; L330-M392 VanDerWaalsContact CD2-CE 3.45Å; L330-M392 HydrophobicContact CD2-CG 3.72Å; L330-M392 HydrophobicContact CD2-SD 4.17Å; L330-M392 HydrophobicContact CG-CE 4.49Å
331	V	94.5	Very high	88.8	Confident	39 Å²	39	28.5 Å²	28.5	24%	0.236	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.5	163.7	-174.7	0	0	0	0	106.3	D336 I337 A588 V589 A590	V331-D336 CarbonylContact C-O 3.57Å; V331-D336 WeakPolarHBondContact CA-O 3.3Å; V331-I337 HydrophobicContact CG2-CG1 4.21Å; V331-A588 HydrophobicContact CG2-CB 3.99Å; V331-V589 WeakPolarHBondContact CG2-O 3.01Å; V331-A590 HydrophobicContact CG1-CB 3.9Å; V331-A590 HydrophobicContact CG2-CB 4.19Å
332	S	92.3	Very high	89.1	Confident	8 Å²	8	27.4 Å²	27.4	6%	0.056	15%	0.148	C	C	.	.			trans	-71.3	162.8	179.5	73.5	0	0	0	0	111	D334 N335 D336	S332-D334 PolarHBondContact O-N 2.85Å; S332-D334 PolarHBondContact OG-N 3.4Å; S332-N335 WeakPolarHBondContact O-CA 3.29Å; S332-N335 PolarHBondContact O-N 3.29Å; S332-N335 PolarHBondContact OG-N 3.11Å; S332-D336 PolarHBondContact N-O 2.78Å; S332-D336 WeakPolarHBondContact OG-CB 3.33Å; S332-D336 PolarHBondContact OG-N 2.83Å
333	P	87.9	Confident	89.4	Confident	98 Å²	98	24.4 Å²	24.4	64%	0.636	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.4	170.7	-26.3	36.3	0	0	0	113.3	N335 Y387	P333-N335 PolarHBondContact O-N 2.86Å; P333-Y387 VanDerWaalsContact CD-CD1 3.49Å; P333-Y387 HydrophobicContact CG-CD1 3.62Å; P333-Y387 HydrophobicContact CG-CE1 3.69Å; P333-Y387 HydrophobicContact CG-CG 4.32Å
334	D	84.6	Confident	89.5	Confident	75 Å²	75	26.3 Å²	26.3	40%	0.401	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	14.5	176.3	-53.7	-47.9	0	0	0	113.4	K178 S332 D336	K178-D334 PolarHBondContact NZ-O 3.42Å; S332-D334 PolarHBondContact O-N 2.85Å; S332-D334 PolarHBondContact OG-N 3.4Å; D334-D336 VanDerWaalsContact C-N 3.28Å; D334-D336 PolarHBondContact O-N 2.91Å
335	N	88.8	Confident	89.1	Confident	30 Å²	30	28 Å²	28	16%	0.16	15%	0.147	C	C	.	.			trans	62.9	26	178.3	-168.8	70.3	0	0	0	114.4	S332 P333 H365 K591	S332-N335 WeakPolarHBondContact O-CA 3.29Å; S332-N335 PolarHBondContact O-N 3.29Å; S332-N335 PolarHBondContact OG-N 3.11Å; P333-N335 PolarHBondContact O-N 2.86Å; N335-H365 PolarHBondContact O-CE1 2.79Å; N335-H365 PolarHBondContact O-NE2 3.26Å; N335-K591 PolarHBondContact ND2-O 3.11Å; N335-K591 PolarHBondContact OD1-N 3.21Å
336	D	90.7	Very high	88.4	Confident	22 Å²	22	28.8 Å²	28.8	12%	0.118	16%	0.159	C	C	.	.			trans	-84.6	132.5	170.6	-61	-46.3	0	0	0	110.5	K178 V331 S332 D334 Y338	K178-D336 WeakPolarHBondContact CE-OD1 3.33Å; K178-D336 WeakPolarHBondContact CE-OD2 3.35Å; K178-D336 IonicContact NZ-OD1 3.45Å; K178-D336 PolarHBondContact NZ-OD1 3.25Å; K178-D336 IonicContact NZ-OD2 2.66Å; K178-D336 PolarHBondContact NZ-OD2 3.19Å; V331-D336 CarbonylContact C-O 3.57Å; V331-D336 WeakPolarHBondContact CA-O 3.3Å; S332-D336 PolarHBondContact N-O 2.78Å; S332-D336 WeakPolarHBondContact OG-CB 3.33Å; S332-D336 PolarHBondContact OG-N 2.83Å; D334-D336 VanDerWaalsContact C-N 3.28Å; D334-D336 PolarHBondContact O-N 2.91Å; D336-Y338 HydrophobicContact CB-CD2 4.17Å; D336-Y338 HydrophobicContact CB-CE2 3.39Å
337	I	94.4	Very high	87.2	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.6	178.3	-53.5	162.2	0	0	0	108.4	I289 F291 L330 V331 M362 Y363 W370 A590 L592	I289-I337 HydrophobicContact CD1-CD1 3.49Å; I289-I337 VanDerWaalsContact CD1-CD1 3.49Å; F291-I337 HydrophobicContact CZ-CG2 4.24Å; L330-I337 WeakPolarHBondContact O-CA 3.26Å; V331-I337 HydrophobicContact CG2-CG1 4.21Å; I337-M362 CarbonylContact O-C 3.59Å; I337-M362 WeakPolarHBondContact O-CA 3.44Å; I337-Y363 HydrophobicContact CD1-CD1 3.9Å; I337-Y363 PolarHBondContact O-N 3.16Å; I337-W370 HydrophobicContact CG2-CH2 4.1Å; I337-A590 HydrophobicContact CD1-CB 3.68Å; I337-A590 HydrophobicContact CG1-CB 3.8Å; I337-L592 HydrophobicContact CD1-CD2 3.78Å
338	Y	94.8	Very high	85.5	Confident	22 Å²	22	35.2 Å²	35.2	9%	0.086	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	146	177	-61.3	-87.7	0	0	0	111.4	I329 L330 D336 F360 W361 M362 M392	I329-Y338 WeakPolarHBondContact CA-O 3.26Å; L330-Y338 PolarHBondContact N-O 3.42Å; L330-Y338 PolarHBondContact O-N 2.7Å; D336-Y338 HydrophobicContact CB-CD2 4.17Å; D336-Y338 HydrophobicContact CB-CE2 3.39Å; Y338-F360 HydrophobicContact CD1-CE1 4.45Å; Y338-F360 AromaticContact CD1-CE2 3.83Å; Y338-F360 HydrophobicContact CD1-CE2 3.83Å; Y338-F360 AromaticContact CD1-CZ 3.53Å; Y338-F360 HydrophobicContact CD1-CZ 3.53Å; Y338-F360 HydrophobicContact CE1-CZ 4.11Å; Y338-F360 HydrophobicContact CG-CE2 4.21Å; Y338-F360 HydrophobicContact CG-CZ 4.21Å; Y338-W361 VanDerWaalsContact CA-O 3.31Å; Y338-W361 WeakPolarHBondContact CA-O 3.25Å; Y338-M362 HydrophobicContact CD1-CB 3.76Å; Y338-M362 HydrophobicContact CD1-CG 3.87Å; Y338-M362 HydrophobicContact CE1-CB 3.65Å; Y338-M362 HydrophobicContact CE1-CG 3.43Å; Y338-M362 VanDerWaalsContact CE1-CG 3.43Å; Y338-M362 HydrophobicContact CE1-SD 3.68Å; Y338-M392 HydrophobicContact CD1-CE 3.85Å; Y338-M392 HydrophobicContact CD1-SD 4.19Å; Y338-M392 HydrophobicContact CD2-CE 3.47Å; Y338-M392 VanDerWaalsContact CD2-CE 3.47Å; Y338-M392 HydrophobicContact CD2-SD 3.82Å; Y338-M392 HydrophobicContact CE1-CE 4.42Å; Y338-M392 HydrophobicContact CE1-SD 4.17Å; Y338-M392 HydrophobicContact CE2-CE 4.08Å; Y338-M392 HydrophobicContact CE2-SD 3.77Å; Y338-M392 HydrophobicContact CG-CE 3.33Å; Y338-M392 HydrophobicContact CG-SD 4.02Å
339	I	94.3	Very high	83.5	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.7	167.9	62.3	177	0	0	0	109.9	F291 P320 V327 G328 I329 F360 W361 W370	F291-I339 HydrophobicContact CE1-CG2 4.12Å; F291-I339 HydrophobicContact CZ-CG2 4.43Å; P320-I339 HydrophobicContact CB-CD1 3.92Å; V327-I339 HydrophobicContact CB-CB 4.27Å; V327-I339 HydrophobicContact CG2-CB 4.06Å; V327-I339 HydrophobicContact CG2-CG2 4Å; G328-I339 CarbonylContact O-C 3.44Å; G328-I339 VanDerWaalsContact O-CA 3.23Å; G328-I339 WeakPolarHBondContact O-CA 3.39Å; I329-I339 HydrophobicContact CG1-CG2 4.19Å; I339-F360 WeakPolarHBondContact O-CD2 3.39Å; I339-W361 HydrophobicContact CD1-CB 4.15Å; I339-W361 HydrophobicContact CD1-CG 4.46Å; I339-W361 HydrophobicContact CG1-CB 3.7Å; I339-W361 HydrophobicContact CG1-CG 4.32Å; I339-W361 PolarHBondContact N-O 3.25Å; I339-W361 PolarHBondContact O-N 2.98Å; I339-W370 HydrophobicContact CB-CH2 4.43Å; I339-W370 HydrophobicContact CB-CZ3 4.18Å; I339-W370 HydrophobicContact CD1-CD2 4.07Å; I339-W370 HydrophobicContact CD1-CE3 3.78Å; I339-W370 HydrophobicContact CD1-CH2 3.94Å; I339-W370 HydrophobicContact CD1-CZ2 4.23Å; I339-W370 HydrophobicContact CD1-CZ3 3.7Å; I339-W370 HydrophobicContact CG1-CE3 3.86Å; I339-W370 HydrophobicContact CG1-CH2 4.08Å; I339-W370 HydrophobicContact CG1-CZ3 3.54Å; I339-W370 HydrophobicContact CG2-CH2 3.57Å; I339-W370 HydrophobicContact CG2-CZ2 4.49Å; I339-W370 HydrophobicContact CG2-CZ3 3.77Å
340	A	94.5	Very high	81.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.008	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	144	178.4	0	0	0	0	0	112.6	G328 D359 F360 L376 L385	G328-A340 PolarHBondContact N-O 3.48Å; G328-A340 PolarHBondContact O-N 3.36Å; A340-D359 CarbonylContact C-O 3.48Å; A340-D359 WeakPolarHBondContact CA-O 3.41Å; A340-F360 HydrophobicContact CB-CD2 3.71Å; A340-F360 HydrophobicContact CB-CE2 4.35Å; A340-L376 HydrophobicContact CB-CD1 3.89Å; A340-L376 HydrophobicContact CB-CG 4.44Å; A340-L385 HydrophobicContact CB-CD1 3.69Å; A340-L385 HydrophobicContact CB-CD2 3.83Å; A340-L385 HydrophobicContact CB-CG 4.15Å
341	G	92	Very high	79.1	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.294	C	S	.	.			trans	64.8	-133.8	177.5	0	0	0	0	0	113	E357 D359 R380	G341-E357 VanDerWaalsContact CA-O 3.28Å; G341-E357 WeakPolarHBondContact CA-O 3.42Å; G341-D359 PolarHBondContact N-O 3.49Å; G341-R380 CarbonylContact C-O 3.53Å; G341-R380 WeakPolarHBondContact CA-O 3.44Å
342	G	89	Confident	77.2	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.314	C	S	.	.			trans	89	-168.2	-172.6	0	0	0	0	0	112.3	R325 E357 R380	R325-G342 CarbonylContact O-C 3.59Å; R325-G342 WeakPolarHBondContact O-CA 3.41Å; G342-E357 PolarHBondContact O-N 3.34Å; G342-R380 PolarHBondContact N-O 3.12Å
343	Y	85	Confident	75.4	Confident	21 Å²	21	60 Å²	60	8%	0.082	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	153.8	173.9	72.2	-82.6	0	0	0	111.2	R325 E326 H354 K355 I381	R325-Y343 HydrophobicContact CB-CD1 4.15Å; R325-Y343 HydrophobicContact CB-CE1 3.64Å; R325-Y343 HydrophobicContact CB-CE2 4.37Å; R325-Y343 PolarHBondContact N-O 3.29Å; R325-Y343 WeakPolarHBondContact O-CD1 3.34Å; R325-Y343 PolarHBondContact O-N 3.08Å; E326-Y343 HydrophobicContact CB-CD1 4.17Å; E326-Y343 HydrophobicContact CB-CE1 4.03Å; E326-Y343 HydrophobicContact CG-CD1 4.49Å; E326-Y343 HydrophobicContact CG-CE1 3.87Å; Y343-H354 HydrophobicContact CD2-CB 3.73Å; Y343-H354 AromaticContact CD2-CG 3.66Å; Y343-H354 AromaticContact CD2-ND1 3.36Å; Y343-H354 WeakPolarHBondContact CD2-ND1 3.35Å; Y343-H354 HydrophobicContact CE2-CB 4.38Å; Y343-H354 AromaticContact CE2-CE1 3.62Å; Y343-H354 AromaticContact CE2-CG 3.8Å; Y343-H354 AromaticContact CE2-ND1 3.23Å; Y343-H354 WeakPolarHBondContact CE2-ND1 3.42Å; Y343-H354 HydrophobicContact CG-CB 3.92Å; Y343-K355 VanDerWaalsContact CA-O 3.31Å; Y343-K355 WeakPolarHBondContact CA-O 3.47Å; Y343-K355 WeakPolarHBondContact CB-O 3.23Å; Y343-I381 HydrophobicContact CD1-CG2 3.81Å; Y343-I381 HydrophobicContact CG-CD1 4.41Å
344	R	80.9	Confident	74.5	Confident	78 Å²	78	57.5 Å²	57.5	29%	0.294	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.1	170.2	-164.9	177.8	-57.9	92.3	4.2	109.3	S346 K355 E357	R344-S346 PolarHBondContact O-N 2.72Å; R344-K355 PolarHBondContact N-O 3.09Å; R344-E357 IonicContact CZ-OE1 3.61Å; R344-E357 IonicContact CZ-OE2 2.69Å; R344-E357 IonicContact NH1-OE1 3.97Å; R344-E357 PolarHBondContact NH1-OE1 3.1Å; R344-E357 IonicContact NH1-OE2 2.89Å; R344-E357 PolarHBondContact NH1-OE2 3.24Å; R344-E357 IonicContact NH2-OE1 3.69Å; R344-E357 PolarHBondContact NH2-OE1 3.11Å; R344-E357 IonicContact NH2-OE2 3.8Å; R344-E357 PolarHBondContact NH2-OE2 2.97Å
345	P	71.6	Confident	74.3	Confident	45 Å²	45	60.5 Å²	60.5	29%	0.292	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-63.8	127.1	173.4	25	-31.3	0	0	0	109.9	D323	D323-P345 WeakPolarHBondContact O-CD 3.43Å
346	S	66.8	Low	74.3	Confident	60 Å²	60	59.7 Å²	59.7	42%	0.42	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-69.6	144.7	170.9	-177.7	0	0	0	0	110	R344 S348	R344-S346 PolarHBondContact O-N 2.72Å; S346-S348 PolarHBondContact O-N 2.93Å; S346-S348 PolarHBondContact OG-N 3.15Å
347	S	59.1	Low	74.3	Confident	131 Å²	131	59.3 Å²	59.3	92%	0.916	32%	0.323	S	S	*	.	S	Bend	trans	-73.9	-10.9	173.4	51.5	0	0	0	0	113.3
348	S	53.6	Low	74.3	Confident	52 Å²	52	61.9 Å²	61.9	36%	0.364	34%	0.337	S	S	.	.			trans	-83.1	120.9	178.5	179	0	0	0	0	111	S346 V350	S346-S348 PolarHBondContact O-N 2.93Å; S346-S348 PolarHBondContact OG-N 3.15Å; S348-V350 PolarHBondContact O-N 2.81Å; S348-V350 PolarHBondContact OG-N 2.86Å
349	E	50.8	Low	74.2	Confident	203 Å²	203	62 Å²	62	95%	0.949	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-7	171.2	-67.6	-174.5	155.2	0	0	113.1
350	V	48.1	Very low	74.3	Confident	139 Å²	139	62 Å²	62	84%	0.842	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-12.2	-165.8	-172.2	0	0	0	0	113.4	S348	S348-V350 PolarHBondContact O-N 2.81Å; S348-V350 PolarHBondContact OG-N 2.86Å
351	S	47.9	Very low	74.3	Confident	44 Å²	44	63.9 Å²	63.9	31%	0.308	35%	0.346	S	S	.	.			trans	-138.4	125	-178.3	55	0	0	0	0	112.1	D353	S351-D353 PolarHBondContact O-N 3.5Å
352	I	53.9	Low	74.3	Confident	125 Å²	125	65.4 Å²	65.4	64%	0.641	35%	0.354	S	S	*	.			trans	-76.8	43.6	170.4	-45.1	175	0	0	0	109.6	H354	I352-H354 VanDerWaalsContact CG2-NE2 3.29Å; I352-H354 WeakPolarHBondContact CG2-NE2 3.38Å; I352-H354 PolarHBondContact O-N 2.92Å
353	D	55.3	Low	74.5	Confident	112 Å²	112	65.5 Å²	65.5	60%	0.599	35%	0.354	S	S	*	.			trans	-80.9	74.8	175.4	-70.8	-14.9	0	0	0	107.6	S351 K355	S351-D353 PolarHBondContact O-N 3.5Å; D353-K355 PolarHBondContact O-N 3.18Å
354	H	69.4	Low	74.6	Confident	46 Å²	46	65.1 Å²	65.1	21%	0.213	35%	0.354	C	S	.	.			trans	-70.4	84.1	167	-63.9	-37.5	0	0	0	107.5	Y343 I352 A356 I381 Y400	Y343-H354 HydrophobicContact CD2-CB 3.73Å; Y343-H354 AromaticContact CD2-CG 3.66Å; Y343-H354 AromaticContact CD2-ND1 3.36Å; Y343-H354 WeakPolarHBondContact CD2-ND1 3.35Å; Y343-H354 HydrophobicContact CE2-CB 4.38Å; Y343-H354 AromaticContact CE2-CE1 3.62Å; Y343-H354 AromaticContact CE2-CG 3.8Å; Y343-H354 AromaticContact CE2-ND1 3.23Å; Y343-H354 WeakPolarHBondContact CE2-ND1 3.42Å; Y343-H354 HydrophobicContact CG-CB 3.92Å; I352-H354 VanDerWaalsContact CG2-NE2 3.29Å; I352-H354 WeakPolarHBondContact CG2-NE2 3.38Å; I352-H354 PolarHBondContact O-N 2.92Å; H354-A356 PolarHBondContact O-N 3.11Å; H354-I381 HydrophobicContact CB-CD1 4.17Å; H354-Y400 HydrophobicContact CB-CD2 3.89Å; H354-Y400 HydrophobicContact CB-CE2 3.74Å; H354-Y400 WeakPolarHBondContact O-CD2 3.43Å
355	K	79.8	Confident	74.8	Confident	138 Å²	138	62.4 Å²	62.4	60%	0.6	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.4	114.8	172.8	-175.5	179.9	174.1	-173.4	0	108	Y343 R344 D353 E357	Y343-K355 VanDerWaalsContact CA-O 3.31Å; Y343-K355 WeakPolarHBondContact CA-O 3.47Å; Y343-K355 WeakPolarHBondContact CB-O 3.23Å; R344-K355 PolarHBondContact N-O 3.09Å; D353-K355 PolarHBondContact O-N 3.18Å; K355-E357 WeakPolarHBondContact CD-OE1 3.43Å
356	A	88.4	Confident	75.1	Confident	12 Å²	12	62.3 Å²	62.3	10%	0.099	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	140.2	172.9	0	0	0	0	0	109	H354 A379 I381 V399	H354-A356 PolarHBondContact O-N 3.11Å; A356-A379 HydrophobicContact CB-CB 3.81Å; A356-I381 HydrophobicContact CB-CD1 3.9Å; A356-I381 HydrophobicContact CB-CG1 3.67Å; A356-V399 HydrophobicContact CB-CG2 3.78Å
357	E	91.2	Very high	75.7	Confident	14 Å²	14	62.5 Å²	62.5	7%	0.065	34%	0.343	C	S	.	.			trans	-110.2	155.9	176.4	-60.2	-68.2	141.3	0	0	109.5	L324 G341 G342 R344 K355 D359 A379 R380	L324-E357 HydrophobicContact CD2-CB 3.85Å; L324-E357 HydrophobicContact CD2-CG 3.73Å; G341-E357 VanDerWaalsContact CA-O 3.28Å; G341-E357 WeakPolarHBondContact CA-O 3.42Å; G342-E357 PolarHBondContact O-N 3.34Å; R344-E357 IonicContact CZ-OE1 3.61Å; R344-E357 IonicContact CZ-OE2 2.69Å; R344-E357 IonicContact NH1-OE1 3.97Å; R344-E357 PolarHBondContact NH1-OE1 3.1Å; R344-E357 IonicContact NH1-OE2 2.89Å; R344-E357 PolarHBondContact NH1-OE2 3.24Å; R344-E357 IonicContact NH2-OE1 3.69Å; R344-E357 PolarHBondContact NH2-OE1 3.11Å; R344-E357 IonicContact NH2-OE2 3.8Å; R344-E357 PolarHBondContact NH2-OE2 2.97Å; K355-E357 WeakPolarHBondContact CD-OE1 3.43Å; E357-D359 HydrophobicContact CB-CB 4.41Å; E357-A379 WeakPolarHBondContact O-CA 3.44Å; E357-R380 PolarHBondContact O-N 3.42Å; E357-R380 VanDerWaalsContact O-N 3.11Å
358	N	93.9	Very high	77.1	Confident	56 Å²	56	57 Å²	57	30%	0.299	30%	0.304	S	S	.	.			trans	-111	11.5	173.4	67.1	-31.7	0	0	0	111.6	S375 L376 A379	N358-S375 CarbonylContact O-C 3.47Å; N358-S375 VanDerWaalsContact O-CA 3.29Å; N358-S375 WeakPolarHBondContact O-CA 3.41Å; N358-S375 VanDerWaalsContact O-CB 3.3Å; N358-S375 WeakPolarHBondContact O-CB 3.06Å; N358-L376 HydrophobicContact CB-CB 3.99Å; N358-L376 WeakPolarHBondContact CB-O 3.26Å; N358-L376 PolarHBondContact ND2-O 3.2Å; N358-L376 PolarHBondContact O-N 2.93Å; N358-A379 HydrophobicContact CB-CB 4.11Å
359	D	92.9	Very high	78.7	Confident	25 Å²	25	62.8 Å²	62.8	13%	0.134	32%	0.318	C	S	.	.			trans	-53.6	135.9	176.9	-85.2	3.9	0	0	0	111.8	N322 L324 A340 G341 E357	N322-D359 PolarHBondContact ND2-OD2 3.01Å; L324-D359 HydrophobicContact CD1-CB 3.93Å; A340-D359 CarbonylContact C-O 3.48Å; A340-D359 WeakPolarHBondContact CA-O 3.41Å; G341-D359 PolarHBondContact N-O 3.49Å; E357-D359 HydrophobicContact CB-CB 4.41Å
360	F	95.1	Very high	80.7	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.5	175.6	-179.2	-133.7	0	0	0	109.3	Y338 I339 A340 K373 P374 M392 Y414 W421	Y338-F360 HydrophobicContact CD1-CE1 4.45Å; Y338-F360 AromaticContact CD1-CE2 3.83Å; Y338-F360 HydrophobicContact CD1-CE2 3.83Å; Y338-F360 AromaticContact CD1-CZ 3.53Å; Y338-F360 HydrophobicContact CD1-CZ 3.53Å; Y338-F360 HydrophobicContact CE1-CZ 4.11Å; Y338-F360 HydrophobicContact CG-CE2 4.21Å; Y338-F360 HydrophobicContact CG-CZ 4.21Å; I339-F360 WeakPolarHBondContact O-CD2 3.39Å; A340-F360 HydrophobicContact CB-CD2 3.71Å; A340-F360 HydrophobicContact CB-CE2 4.35Å; F360-K373 HydrophobicContact CB-CB 4.41Å; F360-K373 HydrophobicContact CD1-CB 3.26Å; F360-K373 HydrophobicContact CD1-CG 4.27Å; F360-K373 HydrophobicContact CE1-CB 3.66Å; F360-K373 HydrophobicContact CE1-CG 4.23Å; F360-K373 HydrophobicContact CG-CB 3.99Å; F360-K373 PolarHBondContact O-N 2.9Å; F360-P374 WeakPolarHBondContact CB-O 3.35Å; F360-P374 WeakPolarHBondContact CD1-O 3.47Å; F360-M392 HydrophobicContact CE2-CE 3.73Å; F360-M392 HydrophobicContact CZ-CE 3.59Å; F360-M392 HydrophobicContact CZ-SD 4.04Å; F360-Y414 HydrophobicContact CD1-CE2 4.4Å; F360-Y414 HydrophobicContact CE1-CD1 4.09Å; F360-Y414 HydrophobicContact CE1-CD2 4.01Å; F360-Y414 AromaticContact CE1-CE1 3.99Å; F360-Y414 HydrophobicContact CE1-CE1 3.99Å; F360-Y414 AromaticContact CE1-CE2 3.89Å; F360-Y414 HydrophobicContact CE1-CE2 3.89Å; F360-Y414 HydrophobicContact CE1-CG 4.1Å; F360-Y414 AromaticContact CE1-CZ 3.89Å; F360-Y414 HydrophobicContact CZ-CD1 4.32Å; F360-Y414 HydrophobicContact CZ-CE1 4.45Å; F360-W421 AromaticContact CD1-CE2 3.99Å; F360-W421 AromaticContact CD1-CZ2 3.85Å; F360-W421 HydrophobicContact CD1-CZ2 3.85Å; F360-W421 AromaticContact CD1-NE1 3.53Å; F360-W421 AromaticContact CD2-CZ2 3.87Å; F360-W421 HydrophobicContact CD2-CZ2 3.87Å; F360-W421 AromaticContact CE1-CZ2 3.88Å; F360-W421 HydrophobicContact CE1-CZ2 3.88Å; F360-W421 AromaticContact CE2-CZ2 3.87Å; F360-W421 HydrophobicContact CE2-CZ2 3.87Å; F360-W421 AromaticContact CG-CZ2 3.87Å; F360-W421 HydrophobicContact CG-CZ2 3.87Å; F360-W421 AromaticContact CG-NE1 3.96Å; F360-W421 AromaticContact CZ-CZ2 3.89Å; F360-W421 HydrophobicContact CZ-CZ2 3.89Å
361	W	94.5	Very high	82.7	Confident	39 Å²	39	51 Å²	51	15%	0.148	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	147.2	-173.9	-56.2	84.6	0	0	0	111.5	P321 Y338 I339 W370 L371 S372	P321-W361 HydrophobicContact CB-CD2 4.04Å; P321-W361 HydrophobicContact CB-CE3 4.27Å; P321-W361 HydrophobicContact CB-CH2 3.87Å; P321-W361 HydrophobicContact CB-CZ2 3.57Å; P321-W361 HydrophobicContact CB-CZ3 4.19Å; P321-W361 HydrophobicContact CG-CD2 3.54Å; P321-W361 HydrophobicContact CG-CE3 3.59Å; P321-W361 HydrophobicContact CG-CG 4.08Å; P321-W361 HydrophobicContact CG-CH2 4.05Å; P321-W361 HydrophobicContact CG-CZ2 3.98Å; P321-W361 HydrophobicContact CG-CZ3 3.84Å; Y338-W361 VanDerWaalsContact CA-O 3.31Å; Y338-W361 WeakPolarHBondContact CA-O 3.25Å; I339-W361 HydrophobicContact CD1-CB 4.15Å; I339-W361 HydrophobicContact CD1-CG 4.46Å; I339-W361 HydrophobicContact CG1-CB 3.7Å; I339-W361 HydrophobicContact CG1-CG 4.32Å; I339-W361 PolarHBondContact N-O 3.25Å; I339-W361 PolarHBondContact O-N 2.98Å; W361-W370 HydrophobicContact CB-CB 4.45Å; W361-W370 HydrophobicContact CB-CE3 3.81Å; W361-W370 HydrophobicContact CE3-CB 3.99Å; W361-L371 WeakPolarHBondContact CA-O 3.24Å; W361-L371 VanDerWaalsContact CE3-C 3.45Å; W361-S372 VanDerWaalsContact CE3-N 3.31Å
362	M	94	Very high	84.8	Confident	32 Å²	32	52.9 Å²	52.9	16%	0.158	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.8	172.5	-174.1	-177.6	78.5	0	0	109.2	I337 Y338 L371 K373	I337-M362 CarbonylContact O-C 3.59Å; I337-M362 WeakPolarHBondContact O-CA 3.44Å; Y338-M362 HydrophobicContact CD1-CB 3.76Å; Y338-M362 HydrophobicContact CD1-CG 3.87Å; Y338-M362 HydrophobicContact CE1-CB 3.65Å; Y338-M362 HydrophobicContact CE1-CG 3.43Å; Y338-M362 VanDerWaalsContact CE1-CG 3.43Å; Y338-M362 HydrophobicContact CE1-SD 3.68Å; M362-L371 HydrophobicContact CE-CD1 3.96Å; M362-L371 PolarHBondContact N-O 3.14Å; M362-L371 PolarHBondContact O-N 3.13Å; M362-K373 HydrophobicContact CB-CG 4.03Å
363	Y	92.4	Very high	86.7	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	126.2	176.7	-179.1	-108.5	0	0	0	110.8	L317 I337 H365 N368 W370 L592 L597	L317-Y363 HydrophobicContact CD1-CD1 4.4Å; L317-Y363 HydrophobicContact CD1-CD2 4.39Å; L317-Y363 HydrophobicContact CD1-CE1 3.93Å; L317-Y363 HydrophobicContact CD1-CE2 3.94Å; L317-Y363 HydrophobicContact CD2-CD2 3.88Å; L317-Y363 HydrophobicContact CD2-CE2 3.52Å; L317-Y363 HydrophobicContact CG-CD2 4.26Å; L317-Y363 HydrophobicContact CG-CE1 4.33Å; L317-Y363 HydrophobicContact CG-CE2 3.53Å; I337-Y363 HydrophobicContact CD1-CD1 3.9Å; I337-Y363 PolarHBondContact O-N 3.16Å; Y363-H365 AromaticContact CD1-CD2 3.92Å; Y363-H365 AromaticContact CD1-NE2 3.99Å; Y363-H365 HydrophobicContact CE1-CB 4.43Å; Y363-H365 AromaticContact CE1-CD2 3.9Å; Y363-N368 PolarHBondContact OH-OD1 2.82Å; Y363-W370 HydrophobicContact CD2-CD2 4.19Å; Y363-W370 AromaticContact CD2-CE2 3.9Å; Y363-W370 HydrophobicContact CD2-CZ2 4.07Å; Y363-W370 HydrophobicContact CG-CZ2 4.48Å; Y363-L592 HydrophobicContact CE1-CD2 4.05Å; Y363-L597 WeakPolarHBondContact OH-CD2 3.36Å
364	D	88	Confident	88.4	Confident	14 Å²	14	46.1 Å²	46.1	8%	0.075	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	113.6	170.8	-176.3	21.5	0	0	0	110.6	K177 S366 T367 N368 R369 L371	K177-D364 WeakPolarHBondContact CE-OD1 3.32Å; K177-D364 VanDerWaalsContact NZ-CG 3.3Å; K177-D364 IonicContact NZ-OD1 3.97Å; K177-D364 PolarHBondContact NZ-OD1 2.89Å; K177-D364 IonicContact NZ-OD2 3.17Å; K177-D364 PolarHBondContact NZ-OD2 2.79Å; K177-D364 VanDerWaalsContact NZ-OD2 3.12Å; D364-S366 PolarHBondContact O-N 2.81Å; D364-S366 PolarHBondContact OD1-N 2.87Å; D364-S366 PolarHBondContact OD1-OG 2.82Å; D364-S366 PolarHBondContact OD2-OG 2.95Å; D364-T367 WeakPolarHBondContact OD2-CB 3.39Å; D364-T367 WeakPolarHBondContact OD2-CG2 3.29Å; D364-T367 PolarHBondContact OD2-OG1 2.99Å; D364-N368 WeakPolarHBondContact O-CA 3.41Å; D364-N368 PolarHBondContact O-N 2.95Å; D364-R369 PolarHBondContact N-O 3.13Å; D364-R369 PolarHBondContact O-N 2.77Å; D364-L371 HydrophobicContact CB-CD1 3.87Å; D364-L371 HydrophobicContact CB-CG 4.01Å
365	H	84.2	Confident	89.6	Confident	21 Å²	21	46.6 Å²	46.6	10%	0.097	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-33.9	-174.7	-62	84.7	0	0	0	113.4	N335 Y363 Y593 C596	N335-H365 PolarHBondContact O-CE1 2.79Å; N335-H365 PolarHBondContact O-NE2 3.26Å; Y363-H365 AromaticContact CD1-CD2 3.92Å; Y363-H365 AromaticContact CD1-NE2 3.99Å; Y363-H365 HydrophobicContact CE1-CB 4.43Å; Y363-H365 AromaticContact CE1-CD2 3.9Å; H365-Y593 HydrophobicContact CB-CD2 3.67Å; H365-Y593 HydrophobicContact CB-CE2 3.49Å; H365-Y593 VanDerWaalsContact CB-CE2 3.49Å; H365-C596 WeakPolarHBondContact O-CB 2.87Å
366	S	77.1	Confident	90.4	Very high	42 Å²	42	40.1 Å²	40.1	29%	0.294	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-41.5	-175.6	61.8	0	0	0	0	111.8	K177 D364	K177-S366 WeakPolarHBondContact CE-OG 3.38Å; K177-S366 PolarHBondContact NZ-OG 2.81Å; D364-S366 PolarHBondContact O-N 2.81Å; D364-S366 PolarHBondContact OD1-N 2.87Å; D364-S366 PolarHBondContact OD1-OG 2.82Å; D364-S366 PolarHBondContact OD2-OG 2.95Å
367	T	81.1	Confident	90.7	Very high	65 Å²	65	44.4 Å²	44.4	40%	0.399	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-7.6	-176.7	65.1	0	0	0	0	113.9	D364 R369	D364-T367 WeakPolarHBondContact OD2-CB 3.39Å; D364-T367 WeakPolarHBondContact OD2-CG2 3.29Å; D364-T367 PolarHBondContact OD2-OG1 2.99Å; T367-R369 VanDerWaalsContact C-N 3.33Å; T367-R369 PolarHBondContact O-N 2.93Å
368	N	87	Confident	90.8	Very high	16 Å²	16	47.9 Å²	47.9	9%	0.086	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	52	-174.1	-173.5	6.8	0	0	0	111	C318 Y363 D364 C596	C318-N368 VanDerWaalsContact CB-O 3.24Å; C318-N368 WeakPolarHBondContact CB-O 3.16Å; C318-N368 WeakPolarHBondContact CB-OD1 3.47Å; C318-N368 PolarHBondContact N-OD1 2.92Å; C318-N368 VanDerWaalsContact SG-C 3.58Å; C318-N368 PolarHBondContact SG-O 3Å; Y363-N368 PolarHBondContact OH-OD1 2.82Å; D364-N368 WeakPolarHBondContact O-CA 3.41Å; D364-N368 PolarHBondContact O-N 2.95Å; N368-C596 WeakPolarHBondContact CB-O 3.5Å; N368-C596 PolarHBondContact ND2-O 3.48Å
369	R	88.6	Confident	90.7	Very high	173 Å²	173	46.2 Å²	46.2	65%	0.653	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-138	156.1	-178.8	-69.6	178.9	-177.3	-168	1.6	110.8	D364 T367	D364-R369 PolarHBondContact N-O 3.13Å; D364-R369 PolarHBondContact O-N 2.77Å; T367-R369 VanDerWaalsContact C-N 3.33Å; T367-R369 PolarHBondContact O-N 2.93Å
370	W	91.4	Very high	90.7	Very high	23 Å²	23	45.1 Å²	45.1	9%	0.087	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.7	171.6	-67.2	92.6	0	0	0	109.7	F291 L317 C318 K319 P321 I337 I339 W361 Y363	F291-W370 AromaticContact CE1-CH2 3.89Å; F291-W370 HydrophobicContact CE1-CH2 3.89Å; F291-W370 AromaticContact CE1-CZ2 3.75Å; F291-W370 HydrophobicContact CE1-CZ2 3.75Å; F291-W370 HydrophobicContact CZ-CH2 4.08Å; F291-W370 HydrophobicContact CZ-CZ2 4.22Å; L317-W370 HydrophobicContact CD2-CZ2 3.97Å; C318-W370 PolarHBondContact O-NE1 3.09Å; C318-W370 PolarHBondContact SG-NE1 3.12Å; C318-W370 VanDerWaalsContact SG-NE1 3.43Å; K319-W370 VanDerWaalsContact O-CD1 3.22Å; K319-W370 PolarHBondContact O-NE1 3.34Å; P321-W370 HydrophobicContact CG-CB 3.45Å; P321-W370 VanDerWaalsContact CG-CB 3.45Å; P321-W370 HydrophobicContact CG-CG 3.86Å; I337-W370 HydrophobicContact CG2-CH2 4.1Å; I339-W370 HydrophobicContact CB-CH2 4.43Å; I339-W370 HydrophobicContact CB-CZ3 4.18Å; I339-W370 HydrophobicContact CD1-CD2 4.07Å; I339-W370 HydrophobicContact CD1-CE3 3.78Å; I339-W370 HydrophobicContact CD1-CH2 3.94Å; I339-W370 HydrophobicContact CD1-CZ2 4.23Å; I339-W370 HydrophobicContact CD1-CZ3 3.7Å; I339-W370 HydrophobicContact CG1-CE3 3.86Å; I339-W370 HydrophobicContact CG1-CH2 4.08Å; I339-W370 HydrophobicContact CG1-CZ3 3.54Å; I339-W370 HydrophobicContact CG2-CH2 3.57Å; I339-W370 HydrophobicContact CG2-CZ2 4.49Å; I339-W370 HydrophobicContact CG2-CZ3 3.77Å; W361-W370 HydrophobicContact CB-CB 4.45Å; W361-W370 HydrophobicContact CB-CE3 3.81Å; W361-W370 HydrophobicContact CE3-CB 3.99Å; Y363-W370 HydrophobicContact CD2-CD2 4.19Å; Y363-W370 AromaticContact CD2-CE2 3.9Å; Y363-W370 HydrophobicContact CD2-CZ2 4.07Å; Y363-W370 HydrophobicContact CG-CZ2 4.48Å
371	L	90.9	Very high	90.5	Very high	72 Å²	72	45.1 Å²	45.1	38%	0.377	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.6	175.4	-60.1	178.6	0	0	0	109.2	W361 M362 D364	W361-L371 WeakPolarHBondContact CA-O 3.24Å; W361-L371 VanDerWaalsContact CE3-C 3.45Å; M362-L371 HydrophobicContact CE-CD1 3.96Å; M362-L371 PolarHBondContact N-O 3.14Å; M362-L371 PolarHBondContact O-N 3.13Å; D364-L371 HydrophobicContact CB-CD1 3.87Å; D364-L371 HydrophobicContact CB-CG 4.01Å
372	S	92.2	Very high	90.2	Very high	83 Å²	83	44.5 Å²	44.5	58%	0.58	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	136.3	177.7	-169	0	0	0	0	109.7	W361	W361-S372 VanDerWaalsContact CE3-N 3.31Å
373	K	92.6	Very high	90.1	Very high	55 Å²	55	43 Å²	43	24%	0.239	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	163.7	174	-73.5	-66.5	-169.7	173.6	0	109.2	F360 M362 S375	F360-K373 HydrophobicContact CB-CB 4.41Å; F360-K373 HydrophobicContact CD1-CB 3.26Å; F360-K373 HydrophobicContact CD1-CG 4.27Å; F360-K373 HydrophobicContact CE1-CB 3.66Å; F360-K373 HydrophobicContact CE1-CG 4.23Å; F360-K373 HydrophobicContact CG-CB 3.99Å; F360-K373 PolarHBondContact O-N 2.9Å; M362-K373 HydrophobicContact CB-CG 4.03Å; K373-S375 PolarHBondContact O-N 2.87Å
374	P	91.7	Very high	90.2	Very high	40 Å²	40	45.4 Å²	45.4	26%	0.26	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-50.2	125.9	178.3	-25.6	31.1	0	0	0	111.5	F360 Y414 N419 W421	F360-P374 WeakPolarHBondContact CB-O 3.35Å; F360-P374 WeakPolarHBondContact CD1-O 3.47Å; P374-Y414 HydrophobicContact CG-CE2 4.27Å; P374-N419 VanDerWaalsContact CD-OD1 3.26Å; P374-N419 WeakPolarHBondContact CD-OD1 3.36Å; P374-N419 WeakPolarHBondContact CG-O 3.36Å; P374-N419 VanDerWaalsContact CG-OD1 3.25Å; P374-N419 WeakPolarHBondContact CG-OD1 3.18Å; P374-W421 PolarHBondContact O-NE1 3.04Å
375	S	94.9	Very high	90.6	Very high	55 Å²	55	45.3 Å²	45.3	39%	0.385	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-62.3	150.4	-178.2	-55.4	0	0	0	0	111.8	N358 K373	N358-S375 CarbonylContact O-C 3.47Å; N358-S375 VanDerWaalsContact O-CA 3.29Å; N358-S375 WeakPolarHBondContact O-CA 3.41Å; N358-S375 VanDerWaalsContact O-CB 3.3Å; N358-S375 WeakPolarHBondContact O-CB 3.06Å; K373-S375 PolarHBondContact O-N 2.87Å
376	L	95.4	Very high	91.2	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-55	150.1	168.6	-63.5	149.8	0	0	0	110.1	A340 N358 R378 A394 W421	A340-L376 HydrophobicContact CB-CD1 3.89Å; A340-L376 HydrophobicContact CB-CG 4.44Å; N358-L376 HydrophobicContact CB-CB 3.99Å; N358-L376 WeakPolarHBondContact CB-O 3.26Å; N358-L376 PolarHBondContact ND2-O 3.2Å; N358-L376 PolarHBondContact O-N 2.93Å; L376-R378 VanDerWaalsContact C-N 3.27Å; L376-R378 WeakPolarHBondContact CB-O 3.36Å; L376-R378 PolarHBondContact O-N 3.33Å; L376-A394 HydrophobicContact CD2-CB 3.53Å; L376-W421 HydrophobicContact CD2-CD2 3.92Å; L376-W421 HydrophobicContact CD2-CE3 3.9Å; L376-W421 HydrophobicContact CD2-CH2 3.66Å; L376-W421 HydrophobicContact CD2-CZ2 3.66Å; L376-W421 HydrophobicContact CD2-CZ3 3.78Å; L376-W421 HydrophobicContact CG-CZ2 4.3Å
377	L	95.4	Very high	92.1	Very high	102 Å²	102	45.7 Å²	45.7	53%	0.534	24%	0.237	S	C	.	.	S	Bend	trans	-66.9	-32	176.1	-57.2	176.5	0	0	0	111.6	E412 W421 T423	L377-E412 WeakPolarHBondContact CB-OE2 3.48Å; L377-E412 PolarHBondContact N-OE2 2.85Å; L377-W421 HydrophobicContact CD1-CB 4.41Å; L377-W421 HydrophobicContact CD2-CB 4.3Å; L377-W421 HydrophobicContact CG-CB 3.89Å; L377-T423 HydrophobicContact CD1-CG2 3.6Å
378	R	92.7	Very high	92.8	Very high	88 Å²	88	42.7 Å²	42.7	33%	0.332	22%	0.219	S	C	.	.	S	Bend	trans	-128.7	140.1	176	-169.8	174.9	176.5	92.7	6.6	110.9	L376 R380 E401 L408 E412	L376-R378 VanDerWaalsContact C-N 3.27Å; L376-R378 WeakPolarHBondContact CB-O 3.36Å; L376-R378 PolarHBondContact O-N 3.33Å; R378-R380 WeakPolarHBondContact O-CG 3.35Å; R378-E401 IonicContact CZ-OE1 2.8Å; R378-E401 IonicContact CZ-OE2 2.57Å; R378-E401 IonicContact NH1-OE2 2.78Å; R378-E401 IonicContact NH2-OE1 3.37Å; R378-E401 PolarHBondContact NH2-OE1 2.65Å; R378-E401 IonicContact NH2-OE2 2.84Å; R378-E401 PolarHBondContact NH2-OE2 2.91Å; R378-L408 VanDerWaalsContact NE-CD2 3.29Å; R378-E412 WeakPolarHBondContact CB-OE1 3.33Å; R378-E412 PolarHBondContact N-OE1 3.1Å
379	A	92.8	Very high	93.1	Very high	21 Å²	21	44.5 Å²	44.5	17%	0.174	23%	0.232	C	C	.	.			trans	-69.5	138.9	174.3	0	0	0	0	0	111.8	A356 E357 N358	A356-A379 HydrophobicContact CB-CB 3.81Å; E357-A379 WeakPolarHBondContact O-CA 3.44Å; N358-A379 HydrophobicContact CB-CB 4.11Å
380	R	92.9	Very high	93.2	Very high	1 Å²	1	38 Å²	38	0%	0.004	22%	0.219	C	C	.	.			trans	-146.6	135.9	-171.8	-55.3	171.1	-177.6	-72.6	-10	111.4	G341 G342 E357 R378 C383 G396 L408 S410 E412	G341-R380 CarbonylContact C-O 3.53Å; G341-R380 WeakPolarHBondContact CA-O 3.44Å; G342-R380 PolarHBondContact N-O 3.12Å; E357-R380 PolarHBondContact O-N 3.42Å; E357-R380 VanDerWaalsContact O-N 3.11Å; R378-R380 WeakPolarHBondContact O-CG 3.35Å; R380-C383 HydrophobicContact CB-CB 3.96Å; R380-G396 PolarHBondContact NH1-O 3.01Å; R380-G396 VanDerWaalsContact NH1-O 3.1Å; R380-L408 HydrophobicContact CB-CD1 4.36Å; R380-L408 HydrophobicContact CG-CD1 3.77Å; R380-S410 VanDerWaalsContact CZ-OG 3.22Å; R380-S410 PolarHBondContact NH1-O 3.13Å; R380-S410 PolarHBondContact NH1-OG 3.09Å; R380-S410 PolarHBondContact NH2-OG 3.42Å; R380-E412 IonicContact CZ-OE1 2.75Å; R380-E412 VanDerWaalsContact CZ-OE1 3.24Å; R380-E412 IonicContact NE-OE1 2.76Å; R380-E412 PolarHBondContact NE-OE1 2.77Å; R380-E412 IonicContact NH2-OE1 3.99Å; R380-E412 PolarHBondContact NH2-OE1 3.01Å
381	I	91.1	Very high	93.3	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-108	131.7	170.9	-55.2	170.4	0	0	0	108.9	E326 Y343 H354 A356 C383 G397 R398 Y400	E326-I381 HydrophobicContact CB-CG2 3.9Å; Y343-I381 HydrophobicContact CD1-CG2 3.81Å; Y343-I381 HydrophobicContact CG-CD1 4.41Å; H354-I381 HydrophobicContact CB-CD1 4.17Å; A356-I381 HydrophobicContact CB-CD1 3.9Å; A356-I381 HydrophobicContact CB-CG1 3.67Å; I381-C383 VanDerWaalsContact C-N 3.27Å; I381-C383 PolarHBondContact O-N 2.8Å; I381-G397 WeakPolarHBondContact O-CA 3.45Å; I381-R398 HydrophobicContact CB-CG 3.86Å; I381-R398 HydrophobicContact CG2-CG 4.35Å; I381-R398 PolarHBondContact N-O 3.3Å; I381-R398 PolarHBondContact O-N 3.18Å; I381-Y400 HydrophobicContact CD1-CD2 3.61Å; I381-Y400 HydrophobicContact CD1-CE2 3.66Å
382	G	87.6	Confident	93.6	Very high	26 Å²	26	37.4 Å²	37.4	27%	0.268	21%	0.214	S	C	.	.	S	Bend	trans	63.7	29.7	176.3	0	0	0	0	0	114.2	E326	E326-G382 WeakPolarHBondContact O-CA 3.46Å; E326-G382 PolarHBondContact O-N 3.26Å
383	C	93.1	Very high	93.8	Very high	2 Å²	2	34 Å²	34	1%	0.014	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-67.6	157.5	171.2	70.6	0	0	0	0	111	G328 R380 I381	G328-C383 VanDerWaalsContact CA-O 3.28Å; G328-C383 WeakPolarHBondContact CA-O 3.39Å; R380-C383 HydrophobicContact CB-CB 3.96Å; I381-C383 VanDerWaalsContact C-N 3.27Å; I381-C383 PolarHBondContact O-N 2.8Å
384	K	94.4	Very high	94	Very high	52 Å²	52	31.3 Å²	31.3	23%	0.226	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.8	171.2	-65.4	-60.6	-176.3	-178.6	0	109.7	I395 H434 A436	K384-I395 PolarHBondContact N-O 3.25Å; K384-I395 VanDerWaalsContact N-O 3.13Å; K384-I395 PolarHBondContact O-N 2.98Å; K384-H434 WeakPolarHBondContact CE-O 3Å; K384-H434 WeakPolarHBondContact CG-O 3.47Å; K384-A436 HydrophobicContact CB-CB 3.79Å; K384-A436 HydrophobicContact CG-CB 4.39Å
385	L	96.1	Very high	94.3	Very high	12 Å²	12	29.5 Å²	29.5	6%	0.063	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.7	172.1	-67.5	-179.3	0	0	0	109.3	G328 L330 A340 Y393 A394 W421	G328-L385 WeakPolarHBondContact O-CD1 3.33Å; L330-L385 HydrophobicContact CB-CB 3.64Å; L330-L385 HydrophobicContact CB-CD1 4.08Å; L330-L385 HydrophobicContact CD2-CB 4.41Å; L330-L385 HydrophobicContact CG-CB 4.49Å; A340-L385 HydrophobicContact CB-CD1 3.69Å; A340-L385 HydrophobicContact CB-CD2 3.83Å; A340-L385 HydrophobicContact CB-CG 4.15Å; L385-Y393 CarbonylContact C-O 3.42Å; L385-Y393 VanDerWaalsContact CA-O 3.26Å; L385-Y393 WeakPolarHBondContact CA-O 3.35Å; L385-A394 HydrophobicContact CD2-CB 3.75Å; L385-W421 HydrophobicContact CD2-CH2 4.32Å
386	V	96.4	Very high	94.3	Very high	6 Å²	6	26.9 Å²	26.9	4%	0.036	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	135	179.5	-177.8	0	0	0	0	109.5	M392 Y393 I395 A436 E438 I443	V386-M392 CarbonylContact O-C 3.57Å; V386-M392 WeakPolarHBondContact O-CA 3.42Å; V386-Y393 PolarHBondContact N-O 3.22Å; V386-Y393 PolarHBondContact O-N 3.38Å; V386-I395 HydrophobicContact CG2-CD1 4.11Å; V386-A436 HydrophobicContact CG2-CB 3.48Å; V386-A436 VanDerWaalsContact CG2-CB 3.48Å; V386-E438 HydrophobicContact CG1-CB 3.67Å; V386-I443 HydrophobicContact CB-CD1 4.43Å; V386-I443 HydrophobicContact CB-CG2 4.46Å; V386-I443 HydrophobicContact CG1-CD1 4.21Å; V386-I443 HydrophobicContact CG1-CG1 3.96Å; V386-I443 HydrophobicContact CG1-CG2 4.19Å; V386-I443 HydrophobicContact CG2-CG2 4.31Å
387	Y	96.1	Very high	94.1	Very high	65 Å²	65	26.8 Å²	26.8	26%	0.255	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.1	170.7	-173.5	-89.4	0	0	0	108.8	P333 G390 K391 M392 E438	P333-Y387 VanDerWaalsContact CD-CD1 3.49Å; P333-Y387 HydrophobicContact CG-CD1 3.62Å; P333-Y387 HydrophobicContact CG-CE1 3.69Å; P333-Y387 HydrophobicContact CG-CG 4.32Å; Y387-G390 WeakPolarHBondContact OH-CA 3.37Å; Y387-K391 WeakPolarHBondContact CA-O 3.34Å; Y387-M392 HydrophobicContact CD2-CG 3.94Å; Y387-E438 WeakPolarHBondContact O-CB 3.48Å; Y387-E438 WeakPolarHBondContact O-CG 3.47Å
388	C	95.9	Very high	94	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.007	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	135.4	179.4	-168.3	0	0	0	0	110.5	G390 K391 Y393 E438 I443	C388-G390 VanDerWaalsContact C-N 3.28Å; C388-G390 PolarHBondContact O-N 2.86Å; C388-K391 PolarHBondContact N-O 3.21Å; C388-K391 PolarHBondContact O-N 3.46Å; C388-K391 VanDerWaalsContact O-O 3.07Å; C388-Y393 HydrophobicContact CB-CD2 4.13Å; C388-Y393 HydrophobicContact CB-CE2 3.95Å; C388-Y393 WeakPolarHBondContact O-CE2 3.45Å; C388-E438 HydrophobicContact CB-CG 3.85Å; C388-I443 HydrophobicContact CB-CD1 3.74Å; C388-I443 HydrophobicContact CB-CG1 3.67Å
389	C	92.3	Very high	93.9	Very high	54 Å²	54	18.7 Å²	18.7	37%	0.365	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	43.1	177.6	-55.4	0	0	0	0	114.1	K391 E441	C389-K391 VanDerWaalsContact C-N 3.26Å; C389-K391 PolarHBondContact O-N 2.74Å; C389-E441 VanDerWaalsContact SG-CB 3.59Å
390	G	90.4	Very high	93.5	Very high	37 Å²	37	21.1 Å²	21.1	38%	0.381	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	-4.4	178.7	0	0	0	0	0	115.6	Y387 C388	Y387-G390 WeakPolarHBondContact OH-CA 3.37Å; C388-G390 VanDerWaalsContact C-N 3.28Å; C388-G390 PolarHBondContact O-N 2.86Å
391	K	94.3	Very high	92.8	Very high	75 Å²	75	25.2 Å²	25.2	33%	0.326	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	159.7	-176.2	-57.1	-167	-171.6	-154.5	0	111.7	Y387 C388 C389 Y393 C413 Y414 D415	Y387-K391 WeakPolarHBondContact CA-O 3.34Å; C388-K391 PolarHBondContact N-O 3.21Å; C388-K391 PolarHBondContact O-N 3.46Å; C388-K391 VanDerWaalsContact O-O 3.07Å; C389-K391 VanDerWaalsContact C-N 3.26Å; C389-K391 PolarHBondContact O-N 2.74Å; K391-Y393 HydrophobicContact CB-CE2 3.95Å; K391-C413 VanDerWaalsContact CB-SG 3.57Å; K391-C413 WeakPolarHBondContact CD-SG 3.34Å; K391-Y414 WeakPolarHBondContact CB-O 3.14Å; K391-D415 HydrophobicContact CD-CB 4.48Å; K391-D415 WeakPolarHBondContact CE-OD2 3.34Å; K391-D415 IonicContact NZ-OD2 2.86Å; K391-D415 PolarHBondContact NZ-OD2 2.83Å
392	M	96.4	Very high	92.1	Very high	7 Å²	7	29 Å²	29	3%	0.034	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	143.4	175.1	-59.8	168	60.5	0	0	110.5	L330 Y338 F360 V386 Y387 C413 Y414	L330-M392 HydrophobicContact CB-CE 4.48Å; L330-M392 HydrophobicContact CD2-CB 4.22Å; L330-M392 HydrophobicContact CD2-CE 3.45Å; L330-M392 VanDerWaalsContact CD2-CE 3.45Å; L330-M392 HydrophobicContact CD2-CG 3.72Å; L330-M392 HydrophobicContact CD2-SD 4.17Å; L330-M392 HydrophobicContact CG-CE 4.49Å; Y338-M392 HydrophobicContact CD1-CE 3.85Å; Y338-M392 HydrophobicContact CD1-SD 4.19Å; Y338-M392 HydrophobicContact CD2-CE 3.47Å; Y338-M392 VanDerWaalsContact CD2-CE 3.47Å; Y338-M392 HydrophobicContact CD2-SD 3.82Å; Y338-M392 HydrophobicContact CE1-CE 4.42Å; Y338-M392 HydrophobicContact CE1-SD 4.17Å; Y338-M392 HydrophobicContact CE2-CE 4.08Å; Y338-M392 HydrophobicContact CE2-SD 3.77Å; Y338-M392 HydrophobicContact CG-CE 3.33Å; Y338-M392 HydrophobicContact CG-SD 4.02Å; F360-M392 HydrophobicContact CE2-CE 3.73Å; F360-M392 HydrophobicContact CZ-CE 3.59Å; F360-M392 HydrophobicContact CZ-SD 4.04Å; V386-M392 CarbonylContact O-C 3.57Å; V386-M392 WeakPolarHBondContact O-CA 3.42Å; Y387-M392 HydrophobicContact CD2-CG 3.94Å; M392-C413 CarbonylContact O-C 3.54Å; M392-C413 VanDerWaalsContact O-CA 3.29Å; M392-C413 WeakPolarHBondContact O-CA 3.48Å; M392-Y414 PolarHBondContact N-O 3.44Å; M392-Y414 VanDerWaalsContact N-O 3.1Å; M392-Y414 PolarHBondContact O-N 3.34Å; M392-Y414 HydrophobicContact SD-CD1 4.04Å
393	Y	97.5	Very high	91.1	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.043	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129	-178.3	-65.7	-97.1	0	0	0	110.1	L385 V386 C388 K391 V411 E412 C413 V424 I443 Y454 P456	L385-Y393 CarbonylContact C-O 3.42Å; L385-Y393 VanDerWaalsContact CA-O 3.26Å; L385-Y393 WeakPolarHBondContact CA-O 3.35Å; V386-Y393 PolarHBondContact N-O 3.22Å; V386-Y393 PolarHBondContact O-N 3.38Å; C388-Y393 HydrophobicContact CB-CD2 4.13Å; C388-Y393 HydrophobicContact CB-CE2 3.95Å; C388-Y393 WeakPolarHBondContact O-CE2 3.45Å; K391-Y393 HydrophobicContact CB-CE2 3.95Å; Y393-V411 HydrophobicContact CD1-CG1 4.34Å; Y393-E412 CarbonylContact C-O 3.59Å; Y393-E412 VanDerWaalsContact CA-O 3.26Å; Y393-E412 WeakPolarHBondContact CA-O 3.33Å; Y393-C413 HydrophobicContact CD1-CB 3.93Å; Y393-C413 HydrophobicContact CE1-CB 3.69Å; Y393-C413 VanDerWaalsContact CE1-SG 3.55Å; Y393-C413 VanDerWaalsContact CZ-SG 3.54Å; Y393-V424 HydrophobicContact CD1-CG2 4.44Å; Y393-I443 HydrophobicContact CD1-CD1 4.11Å; Y393-I443 HydrophobicContact CD2-CD1 3.49Å; Y393-I443 VanDerWaalsContact CD2-CD1 3.49Å; Y393-I443 HydrophobicContact CE2-CD1 4.04Å; Y393-I443 HydrophobicContact CG-CD1 3.54Å; Y393-Y454 HydrophobicContact CD1-CE1 4.19Å; Y393-Y454 AromaticContact CE1-CE1 3.74Å; Y393-Y454 HydrophobicContact CE1-CE1 3.74Å; Y393-P456 WeakPolarHBondContact OH-CB 3.34Å
394	A	97.3	Very high	90.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	113.6	170.7	0	0	0	0	0	109.6	L376 L385 V411 E412 W421	L376-A394 HydrophobicContact CD2-CB 3.53Å; L385-A394 HydrophobicContact CD2-CB 3.75Å; A394-V411 WeakPolarHBondContact O-CA 3.46Å; A394-E412 HydrophobicContact CB-CB 4.5Å; A394-E412 PolarHBondContact N-O 3.33Å; A394-E412 PolarHBondContact O-N 2.96Å; A394-W421 HydrophobicContact CB-CH2 3.96Å; A394-W421 HydrophobicContact CB-CZ3 3.7Å
395	I	97	Very high	90.1	Very high	1 Å²	1	40 Å²	40	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.2	-168.1	-57	171	0	0	0	110	K384 V386 V411 M427 H434 A436 I443 V445	K384-I395 PolarHBondContact N-O 3.25Å; K384-I395 VanDerWaalsContact N-O 3.13Å; K384-I395 PolarHBondContact O-N 2.98Å; V386-I395 HydrophobicContact CG2-CD1 4.11Å; I395-V411 HydrophobicContact CG1-CG1 3.87Å; I395-V411 HydrophobicContact CG1-CG2 4.46Å; I395-V411 HydrophobicContact CG2-CG2 4.15Å; I395-M427 HydrophobicContact CG2-CE 4.03Å; I395-M427 HydrophobicContact CG2-CG 4.49Å; I395-M427 HydrophobicContact CG2-SD 3.52Å; I395-M427 VanDerWaalsContact CG2-SD 3.52Å; I395-H434 PolarHBondContact O-CE1 2.91Å; I395-H434 PolarHBondContact O-NE2 2.89Å; I395-H434 VanDerWaalsContact O-NE2 3.14Å; I395-A436 HydrophobicContact CD1-CB 3.93Å; I395-I443 HydrophobicContact CD1-CD1 4.48Å; I395-I443 HydrophobicContact CD1-CG2 3.6Å; I395-V445 HydrophobicContact CD1-CG2 4.23Å; I395-V445 HydrophobicContact CG2-CG2 4.14Å
396	G	94.8	Very high	89.8	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.243	C	C	.	.			trans	56.7	-136.8	169.7	0	0	0	0	0	114.6	R380 L408 S410	R380-G396 PolarHBondContact NH1-O 3.01Å; R380-G396 VanDerWaalsContact NH1-O 3.1Å; G396-L408 WeakPolarHBondContact CA-O 3.23Å; G396-S410 PolarHBondContact N-O 2.92Å
397	G	92.8	Very high	89.7	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	26%	0.257	C	S	.	.			trans	98.6	-166.2	-176.5	0	0	0	0	0	111.6	I381 L408 M431	I381-G397 WeakPolarHBondContact O-CA 3.45Å; G397-L408 PolarHBondContact O-N 2.68Å; G397-M431 PolarHBondContact N-O 2.66Å; G397-M431 VanDerWaalsContact N-O 3.11Å
398	R	91.5	Very high	89.6	Confident	16 Å²	16	42.3 Å²	42.3	6%	0.06	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	159.6	177.1	71.1	-177.7	-174.6	-124	-8.8	112.2	E326 I381 R405 N406	E326-R398 IonicContact OE1-NH2 2.83Å; E326-R398 PolarHBondContact OE1-NH2 3.18Å; E326-R398 IonicContact OE2-CZ 3.56Å; E326-R398 IonicContact OE2-NH1 2.78Å; E326-R398 IonicContact OE2-NH2 3.58Å; E326-R398 PolarHBondContact OE2-NH2 3.2Å; I381-R398 HydrophobicContact CB-CG 3.86Å; I381-R398 HydrophobicContact CG2-CG 4.35Å; I381-R398 PolarHBondContact N-O 3.3Å; I381-R398 PolarHBondContact O-N 3.18Å; R398-R405 VanDerWaalsContact CD-NE 3.31Å; R398-N406 CarbonylContact C-O 3.42Å; R398-N406 VanDerWaalsContact CA-O 3.22Å; R398-N406 WeakPolarHBondContact CA-O 3.43Å
399	V	90.8	Very high	89.6	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.5	171.6	72.3	0	0	0	0	109.4	A356 E401 N406 L408	A356-V399 HydrophobicContact CB-CG2 3.78Å; V399-E401 HydrophobicContact CG1-CB 4.34Å; V399-E401 HydrophobicContact CG1-CG 4.18Å; V399-E401 HydrophobicContact CG2-CG 3.85Å; V399-E401 WeakPolarHBondContact CG2-OE1 3.31Å; V399-N406 HydrophobicContact CG1-CB 4.16Å; V399-N406 PolarHBondContact N-O 3.32Å; V399-N406 PolarHBondContact O-N 2.73Å; V399-L408 HydrophobicContact CB-CD1 4.44Å; V399-L408 HydrophobicContact CG1-CD2 3.93Å; V399-L408 HydrophobicContact CG1-CG 4.49Å
400	Y	84.6	Confident	89.8	Confident	73 Å²	73	47 Å²	47	29%	0.286	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	98	171.3	-66.2	-88.1	0	0	0	108.1	H354 I381 G404 R405	H354-Y400 HydrophobicContact CB-CD2 3.89Å; H354-Y400 HydrophobicContact CB-CE2 3.74Å; H354-Y400 WeakPolarHBondContact O-CD2 3.43Å; I381-Y400 HydrophobicContact CD1-CD2 3.61Å; I381-Y400 HydrophobicContact CD1-CE2 3.66Å; Y400-G404 WeakPolarHBondContact CA-O 3.48Å; Y400-R405 HydrophobicContact CD1-CB 4.11Å; Y400-R405 HydrophobicContact CE1-CB 3.8Å; Y400-R405 HydrophobicContact CE1-CG 4.1Å
401	E	78.5	Confident	90.1	Very high	86 Å²	86	45.3 Å²	45.3	40%	0.402	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137.4	-178.6	-81.3	173.4	-164.1	0	0	109	R378 V399 D403 G404 N406	R378-E401 IonicContact CZ-OE1 2.8Å; R378-E401 IonicContact CZ-OE2 2.57Å; R378-E401 IonicContact NH1-OE2 2.78Å; R378-E401 IonicContact NH2-OE1 3.37Å; R378-E401 PolarHBondContact NH2-OE1 2.65Å; R378-E401 IonicContact NH2-OE2 2.84Å; R378-E401 PolarHBondContact NH2-OE2 2.91Å; V399-E401 HydrophobicContact CG1-CB 4.34Å; V399-E401 HydrophobicContact CG1-CG 4.18Å; V399-E401 HydrophobicContact CG2-CG 3.85Å; V399-E401 WeakPolarHBondContact CG2-OE1 3.31Å; E401-D403 PolarHBondContact O-N 3.07Å; E401-G404 PolarHBondContact N-O 2.62Å; E401-N406 PolarHBondContact O-ND2 2.72Å
402	G	75.8	Confident	90.2	Very high	82 Å²	82	41.9 Å²	41.9	85%	0.845	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	-123.3	178.5	0	0	0	0	0	113	G404	G402-G404 PolarHBondContact O-N 3.22Å; G402-G404 VanDerWaalsContact O-N 3.1Å
403	D	68.3	Low	90.3	Very high	184 Å²	184	41.7 Å²	41.7	98%	0.984	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	6.7	-172.2	-60.6	-23.6	0	0	0	114.7	E401	E401-D403 PolarHBondContact O-N 3.07Å
404	G	79.9	Confident	90.2	Very high	27 Å²	27	41.4 Å²	41.4	28%	0.278	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	140.1	-135.7	168.6	0	0	0	0	0	114.6	Y400 E401 G402 N406	Y400-G404 WeakPolarHBondContact CA-O 3.48Å; E401-G404 PolarHBondContact N-O 2.62Å; G402-G404 PolarHBondContact O-N 3.22Å; G402-G404 VanDerWaalsContact O-N 3.1Å; G404-N406 PolarHBondContact O-ND2 2.98Å
405	R	86.4	Confident	89.9	Confident	100 Å²	100	42.6 Å²	42.6	38%	0.377	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	115.8	-172.4	-179.4	-176.5	172.7	164.8	7	110.8	R398 Y400 E432	R398-R405 VanDerWaalsContact CD-NE 3.31Å; Y400-R405 HydrophobicContact CD1-CB 4.11Å; Y400-R405 HydrophobicContact CE1-CB 3.8Å; Y400-R405 HydrophobicContact CE1-CG 4.1Å; R405-E432 IonicContact CZ-OE1 3.67Å; R405-E432 IonicContact CZ-OE2 3.63Å; R405-E432 IonicContact NE-OE1 2.69Å; R405-E432 PolarHBondContact NE-OE1 3.32Å; R405-E432 IonicContact NE-OE2 3.3Å; R405-E432 PolarHBondContact NE-OE2 3.33Å; R405-E432 IonicContact NH1-OE1 3.51Å; R405-E432 IonicContact NH2-OE1 3.95Å; R405-E432 PolarHBondContact NH2-OE1 2.73Å; R405-E432 IonicContact NH2-OE2 2.71Å; R405-E432 PolarHBondContact NH2-OE2 3.28Å
406	N	89.8	Confident	89.4	Confident	73 Å²	73	45.4 Å²	45.4	39%	0.39	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.9	-179.1	-65.4	-55	0	0	0	111.6	R398 V399 E401 G404	R398-N406 CarbonylContact C-O 3.42Å; R398-N406 VanDerWaalsContact CA-O 3.22Å; R398-N406 WeakPolarHBondContact CA-O 3.43Å; V399-N406 HydrophobicContact CG1-CB 4.16Å; V399-N406 PolarHBondContact N-O 3.32Å; V399-N406 PolarHBondContact O-N 2.73Å; E401-N406 PolarHBondContact O-ND2 2.72Å; G404-N406 PolarHBondContact O-ND2 2.98Å
407	S	92.9	Very high	88.8	Confident	47 Å²	47	51.3 Å²	51.3	33%	0.329	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	146.8	170.6	-52	0	0	0	0	110.8	E432	S407-E432 WeakPolarHBondContact OG-CG 3.44Å; S407-E432 PolarHBondContact OG-OE2 2.88Å
408	L	94.3	Very high	88.3	Confident	10 Å²	10	56.6 Å²	56.6	5%	0.052	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-105.5	139	-175.2	-60.6	175.2	0	0	0	111.4	R378 R380 G396 G397 V399 M427 M431	R378-L408 VanDerWaalsContact NE-CD2 3.29Å; R380-L408 HydrophobicContact CB-CD1 4.36Å; R380-L408 HydrophobicContact CG-CD1 3.77Å; G396-L408 WeakPolarHBondContact CA-O 3.23Å; G397-L408 PolarHBondContact O-N 2.68Å; V399-L408 HydrophobicContact CB-CD1 4.44Å; V399-L408 HydrophobicContact CG1-CD2 3.93Å; V399-L408 HydrophobicContact CG1-CG 4.49Å; L408-M427 WeakPolarHBondContact O-CE 3.41Å; L408-M431 PolarHBondContact O-N 2.81Å; L408-M431 VanDerWaalsContact O-N 3.09Å
409	K	95.7	Very high	88.1	Confident	124 Å²	124	57.3 Å²	57.3	54%	0.539	31%	0.309	S	S	.	.			trans	-99	-21.2	169.3	64.8	173.4	-177.5	178.5	0	113.7	A426 M427 A430	K409-A426 HydrophobicContact CD-CB 4.29Å; K409-A426 HydrophobicContact CG-CB 4.12Å; K409-A426 CarbonylContact O-C 3.55Å; K409-A426 WeakPolarHBondContact O-CA 3.38Å; K409-M427 HydrophobicContact CB-CB 4.5Å; K409-M427 PolarHBondContact O-N 2.89Å; K409-A430 HydrophobicContact CB-CB 4.19Å
410	S	96.1	Very high	88.2	Confident	31 Å²	31	59.5 Å²	59.5	22%	0.217	32%	0.324	C	S	.	.			trans	-61.1	142.7	-177.4	54.1	0	0	0	0	111.3	R380 G396	R380-S410 VanDerWaalsContact CZ-OG 3.22Å; R380-S410 PolarHBondContact NH1-O 3.13Å; R380-S410 PolarHBondContact NH1-OG 3.09Å; R380-S410 PolarHBondContact NH2-OG 3.42Å; G396-S410 PolarHBondContact N-O 2.92Å
411	V	97.4	Very high	88.7	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.5	174.1	-178.7	0	0	0	0	107.9	Y393 A394 I395 V424 M427 W461	Y393-V411 HydrophobicContact CD1-CG1 4.34Å; A394-V411 WeakPolarHBondContact O-CA 3.46Å; I395-V411 HydrophobicContact CG1-CG1 3.87Å; I395-V411 HydrophobicContact CG1-CG2 4.46Å; I395-V411 HydrophobicContact CG2-CG2 4.15Å; V411-V424 HydrophobicContact CB-CG2 3.76Å; V411-V424 HydrophobicContact CG1-CG2 3.55Å; V411-V424 PolarHBondContact O-N 2.9Å; V411-V424 VanDerWaalsContact O-N 3.13Å; V411-M427 HydrophobicContact CG2-CG 3.86Å; V411-W461 HydrophobicContact CG2-CZ2 3.92Å
412	E	97.2	Very high	89.6	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.009	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144	178.8	-60.7	175.8	-138.8	0	0	109.4	L377 R378 R380 Y393 A394 W421 T422	L377-E412 WeakPolarHBondContact CB-OE2 3.48Å; L377-E412 PolarHBondContact N-OE2 2.85Å; R378-E412 WeakPolarHBondContact CB-OE1 3.33Å; R378-E412 PolarHBondContact N-OE1 3.1Å; R380-E412 IonicContact CZ-OE1 2.75Å; R380-E412 VanDerWaalsContact CZ-OE1 3.24Å; R380-E412 IonicContact NE-OE1 2.76Å; R380-E412 PolarHBondContact NE-OE1 2.77Å; R380-E412 IonicContact NH2-OE1 3.99Å; R380-E412 PolarHBondContact NH2-OE1 3.01Å; Y393-E412 CarbonylContact C-O 3.59Å; Y393-E412 VanDerWaalsContact CA-O 3.26Å; Y393-E412 WeakPolarHBondContact CA-O 3.33Å; A394-E412 HydrophobicContact CB-CB 4.5Å; A394-E412 PolarHBondContact N-O 3.33Å; A394-E412 PolarHBondContact O-N 2.96Å; E412-W421 HydrophobicContact CB-CE3 3.7Å; E412-W421 HydrophobicContact CB-CZ3 4.2Å; E412-T422 CarbonylContact C-O 3.51Å; E412-T422 WeakPolarHBondContact CA-O 3.22Å
413	C	96.9	Very high	90.6	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.027	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.8	179	-177.7	0	0	0	0	109.4	K391 M392 Y393 W421 T422 V424	K391-C413 VanDerWaalsContact CB-SG 3.57Å; K391-C413 WeakPolarHBondContact CD-SG 3.34Å; M392-C413 CarbonylContact O-C 3.54Å; M392-C413 VanDerWaalsContact O-CA 3.29Å; M392-C413 WeakPolarHBondContact O-CA 3.48Å; Y393-C413 HydrophobicContact CD1-CB 3.93Å; Y393-C413 HydrophobicContact CE1-CB 3.69Å; Y393-C413 VanDerWaalsContact CE1-SG 3.55Å; Y393-C413 VanDerWaalsContact CZ-SG 3.54Å; C413-W421 CarbonylContact O-C 3.56Å; C413-W421 WeakPolarHBondContact O-CA 3.33Å; C413-T422 PolarHBondContact N-O 2.94Å; C413-T422 PolarHBondContact O-N 3.09Å; C413-T422 PolarHBondContact O-OG1 3.17Å; C413-V424 HydrophobicContact CB-CG1 3.58Å
414	Y	96.4	Very high	92	Very high	5 Å²	5	49.5 Å²	49.5	2%	0.02	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.4	173.6	178.6	-103.1	0	0	0	109.8	F360 P374 K391 M392 N419 C420 W421	F360-Y414 HydrophobicContact CD1-CE2 4.4Å; F360-Y414 HydrophobicContact CE1-CD1 4.09Å; F360-Y414 HydrophobicContact CE1-CD2 4.01Å; F360-Y414 AromaticContact CE1-CE1 3.99Å; F360-Y414 HydrophobicContact CE1-CE1 3.99Å; F360-Y414 AromaticContact CE1-CE2 3.89Å; F360-Y414 HydrophobicContact CE1-CE2 3.89Å; F360-Y414 HydrophobicContact CE1-CG 4.1Å; F360-Y414 AromaticContact CE1-CZ 3.89Å; F360-Y414 HydrophobicContact CZ-CD1 4.32Å; F360-Y414 HydrophobicContact CZ-CE1 4.45Å; P374-Y414 HydrophobicContact CG-CE2 4.27Å; K391-Y414 WeakPolarHBondContact CB-O 3.14Å; M392-Y414 PolarHBondContact N-O 3.44Å; M392-Y414 VanDerWaalsContact N-O 3.1Å; M392-Y414 PolarHBondContact O-N 3.34Å; M392-Y414 HydrophobicContact SD-CD1 4.04Å; Y414-N419 PolarHBondContact OH-OD1 2.88Å; Y414-C420 WeakPolarHBondContact CD2-O 3.44Å; Y414-W421 AromaticContact CD2-CD1 3.8Å; Y414-W421 HydrophobicContact CD2-CD2 4.03Å; Y414-W421 AromaticContact CD2-CE2 3.74Å; Y414-W421 HydrophobicContact CD2-CG 4.07Å; Y414-W421 HydrophobicContact CD2-CZ2 4.29Å; Y414-W421 AromaticContact CD2-NE1 3.59Å; Y414-W421 HydrophobicContact CG-CD2 4.28Å; Y414-W421 AromaticContact CG-CE2 4Å; Y414-W421 HydrophobicContact CG-CZ2 4.14Å
415	D	91.2	Very high	92.8	Very high	25 Å²	25	50.5 Å²	50.5	13%	0.134	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.3	170.4	-160.9	-41.6	0	0	0	109	K391 R417 E418 N419 C420	K391-D415 HydrophobicContact CD-CB 4.48Å; K391-D415 WeakPolarHBondContact CE-OD2 3.34Å; K391-D415 IonicContact NZ-OD2 2.86Å; K391-D415 PolarHBondContact NZ-OD2 2.83Å; D415-R417 VanDerWaalsContact C-N 3.27Å; D415-R417 PolarHBondContact O-N 2.88Å; D415-R417 WeakPolarHBondContact OD1-CB 3.23Å; D415-R417 PolarHBondContact OD1-N 2.96Å; D415-E418 HydrophobicContact CB-CB 4.21Å; D415-E418 HydrophobicContact CB-CG 4.36Å; D415-N419 WeakPolarHBondContact O-CA 3.39Å; D415-N419 PolarHBondContact O-N 2.8Å; D415-C420 PolarHBondContact N-O 2.87Å; D415-C420 VanDerWaalsContact N-O 3.13Å; D415-C420 PolarHBondContact O-N 3.2Å
416	S	86.2	Confident	93.3	Very high	60 Å²	60	47.5 Å²	47.5	42%	0.42	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-25.1	-179.3	57.3	0	0	0	0	112.9
417	R	81.6	Confident	93.6	Very high	123 Å²	123	44.2 Å²	44.2	46%	0.464	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-54.8	-179.8	-63.2	178.7	173.8	-155.4	-10.7	110.5	D415 N419	D415-R417 VanDerWaalsContact C-N 3.27Å; D415-R417 PolarHBondContact O-N 2.88Å; D415-R417 WeakPolarHBondContact OD1-CB 3.23Å; D415-R417 PolarHBondContact OD1-N 2.96Å; R417-N419 PolarHBondContact O-N 2.72Å
418	E	83.2	Confident	93.7	Very high	113 Å²	113	45 Å²	45	53%	0.528	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.1	177.5	-56.9	-62.9	150.9	0	0	112.8	D415 C420	D415-E418 HydrophobicContact CB-CB 4.21Å; D415-E418 HydrophobicContact CB-CG 4.36Å; E418-C420 VanDerWaalsContact CB-SG 3.58Å; E418-C420 PolarHBondContact O-N 3.41Å; E418-C420 VanDerWaalsContact O-N 3.14Å
419	N	87.6	Confident	93.7	Very high	31 Å²	31	46.6 Å²	46.6	17%	0.166	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	48.3	-178.6	-171.2	41.6	0	0	0	111.1	P374 Y414 D415 R417	P374-N419 VanDerWaalsContact CD-OD1 3.26Å; P374-N419 WeakPolarHBondContact CD-OD1 3.36Å; P374-N419 WeakPolarHBondContact CG-O 3.36Å; P374-N419 VanDerWaalsContact CG-OD1 3.25Å; P374-N419 WeakPolarHBondContact CG-OD1 3.18Å; Y414-N419 PolarHBondContact OH-OD1 2.88Å; D415-N419 WeakPolarHBondContact O-CA 3.39Å; D415-N419 PolarHBondContact O-N 2.8Å; R417-N419 PolarHBondContact O-N 2.72Å
420	C	91.6	Very high	93.6	Very high	49 Å²	49	42.9 Å²	42.9	33%	0.331	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155.8	-178.5	71.4	0	0	0	0	112.5	Y414 D415 E418	Y414-C420 WeakPolarHBondContact CD2-O 3.44Å; D415-C420 PolarHBondContact N-O 2.87Å; D415-C420 VanDerWaalsContact N-O 3.13Å; D415-C420 PolarHBondContact O-N 3.2Å; E418-C420 VanDerWaalsContact CB-SG 3.58Å; E418-C420 PolarHBondContact O-N 3.41Å; E418-C420 VanDerWaalsContact O-N 3.14Å
421	W	96.9	Very high	93.4	Very high	14 Å²	14	41.4 Å²	41.4	5%	0.053	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	139.3	172.3	-69.8	91.2	0	0	0	110.3	F360 P374 L376 L377 L385 A394 E412 C413 Y414	F360-W421 AromaticContact CD1-CE2 3.99Å; F360-W421 AromaticContact CD1-CZ2 3.85Å; F360-W421 HydrophobicContact CD1-CZ2 3.85Å; F360-W421 AromaticContact CD1-NE1 3.53Å; F360-W421 AromaticContact CD2-CZ2 3.87Å; F360-W421 HydrophobicContact CD2-CZ2 3.87Å; F360-W421 AromaticContact CE1-CZ2 3.88Å; F360-W421 HydrophobicContact CE1-CZ2 3.88Å; F360-W421 AromaticContact CE2-CZ2 3.87Å; F360-W421 HydrophobicContact CE2-CZ2 3.87Å; F360-W421 AromaticContact CG-CZ2 3.87Å; F360-W421 HydrophobicContact CG-CZ2 3.87Å; F360-W421 AromaticContact CG-NE1 3.96Å; F360-W421 AromaticContact CZ-CZ2 3.89Å; F360-W421 HydrophobicContact CZ-CZ2 3.89Å; P374-W421 PolarHBondContact O-NE1 3.04Å; L376-W421 HydrophobicContact CD2-CD2 3.92Å; L376-W421 HydrophobicContact CD2-CE3 3.9Å; L376-W421 HydrophobicContact CD2-CH2 3.66Å; L376-W421 HydrophobicContact CD2-CZ2 3.66Å; L376-W421 HydrophobicContact CD2-CZ3 3.78Å; L376-W421 HydrophobicContact CG-CZ2 4.3Å; L377-W421 HydrophobicContact CD1-CB 4.41Å; L377-W421 HydrophobicContact CD2-CB 4.3Å; L377-W421 HydrophobicContact CG-CB 3.89Å; L385-W421 HydrophobicContact CD2-CH2 4.32Å; A394-W421 HydrophobicContact CB-CH2 3.96Å; A394-W421 HydrophobicContact CB-CZ3 3.7Å; E412-W421 HydrophobicContact CB-CE3 3.7Å; E412-W421 HydrophobicContact CB-CZ3 4.2Å; C413-W421 CarbonylContact O-C 3.56Å; C413-W421 WeakPolarHBondContact O-CA 3.33Å; Y414-W421 AromaticContact CD2-CD1 3.8Å; Y414-W421 HydrophobicContact CD2-CD2 4.03Å; Y414-W421 AromaticContact CD2-CE2 3.74Å; Y414-W421 HydrophobicContact CD2-CG 4.07Å; Y414-W421 HydrophobicContact CD2-CZ2 4.29Å; Y414-W421 AromaticContact CD2-NE1 3.59Å; Y414-W421 HydrophobicContact CG-CD2 4.28Å; Y414-W421 AromaticContact CG-CE2 4Å; Y414-W421 HydrophobicContact CG-CZ2 4.14Å
422	T	96.6	Very high	92.9	Very high	63 Å²	63	43.1 Å²	43.1	39%	0.387	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148.6	175	56.3	0	0	0	0	109.8	E412 C413	E412-T422 CarbonylContact C-O 3.51Å; E412-T422 WeakPolarHBondContact CA-O 3.22Å; C413-T422 PolarHBondContact N-O 2.94Å; C413-T422 PolarHBondContact O-N 3.09Å; C413-T422 PolarHBondContact O-OG1 3.17Å
423	T	96.9	Very high	92.3	Very high	108 Å²	108	46 Å²	46	66%	0.663	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	136.1	173.5	53.8	0	0	0	0	110.3	L377	L377-T423 HydrophobicContact CD1-CG2 3.6Å
424	V	97.1	Very high	92	Very high	29 Å²	29	46 Å²	46	18%	0.176	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	178.1	171.2	-60.5	0	0	0	0	110.3	Y393 V411 C413 A426 Y454	Y393-V424 HydrophobicContact CD1-CG2 4.44Å; V411-V424 HydrophobicContact CB-CG2 3.76Å; V411-V424 HydrophobicContact CG1-CG2 3.55Å; V411-V424 PolarHBondContact O-N 2.9Å; V411-V424 VanDerWaalsContact O-N 3.13Å; C413-V424 HydrophobicContact CB-CG1 3.58Å; V424-A426 PolarHBondContact O-N 2.78Å; V424-Y454 WeakPolarHBondContact CB-OH 3.41Å
425	C	96.6	Very high	91.9	Very high	48 Å²	48	46.4 Å²	46.4	32%	0.324	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-52.5	124.7	-179.8	-172.9	0	0	0	0	110.8	Y454 D459 W461	C425-Y454 HydrophobicContact CB-CE2 4.43Å; C425-D459 WeakPolarHBondContact CA-OD1 3.49Å; C425-D459 VanDerWaalsContact CB-CG 3.42Å; C425-D459 VanDerWaalsContact CB-O 3.23Å; C425-D459 WeakPolarHBondContact CB-O 3.11Å; C425-D459 WeakPolarHBondContact CB-OD1 3.3Å; C425-D459 PolarHBondContact N-OD1 2.81Å; C425-D459 PolarHBondContact N-OD2 3.44Å; C425-W461 PolarHBondContact O-NE1 3.34Å
426	A	97.1	Very high	92.1	Very high	38 Å²	38	46 Å²	46	31%	0.314	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-70.3	149.9	-179.1	0	0	0	0	0	111	K409 V424	K409-A426 HydrophobicContact CD-CB 4.29Å; K409-A426 HydrophobicContact CG-CB 4.12Å; K409-A426 CarbonylContact O-C 3.55Å; K409-A426 WeakPolarHBondContact O-CA 3.38Å; V424-A426 PolarHBondContact O-N 2.78Å
427	M	96.5	Very high	92.5	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.015	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-56.6	144.2	172.6	-66.2	-178.2	-64.6	0	0	110.6	I395 L408 K409 V411 V429 M431 V445 W461	I395-M427 HydrophobicContact CG2-CE 4.03Å; I395-M427 HydrophobicContact CG2-CG 4.49Å; I395-M427 HydrophobicContact CG2-SD 3.52Å; I395-M427 VanDerWaalsContact CG2-SD 3.52Å; L408-M427 WeakPolarHBondContact O-CE 3.41Å; K409-M427 HydrophobicContact CB-CB 4.5Å; K409-M427 PolarHBondContact O-N 2.89Å; V411-M427 HydrophobicContact CG2-CG 3.86Å; M427-V429 WeakPolarHBondContact CB-O 3.28Å; M427-V429 PolarHBondContact O-N 3.46Å; M427-M431 HydrophobicContact CE-CB 3.87Å; M427-M431 HydrophobicContact CE-CG 4.4Å; M427-M431 HydrophobicContact SD-CB 4.34Å; M427-M431 HydrophobicContact SD-CG 4.43Å; M427-M431 HydrophobicContact SD-SD 4.2Å; M427-V445 HydrophobicContact SD-CG1 4.18Å; M427-W461 HydrophobicContact CG-CD2 4.42Å; M427-W461 HydrophobicContact CG-CH2 3.79Å; M427-W461 HydrophobicContact CG-CZ2 3.66Å; M427-W461 HydrophobicContact CG-CZ3 4.23Å; M427-W461 HydrophobicContact SD-CH2 4.41Å
428	P	95.4	Very high	93.2	Very high	64 Å²	64	41.5 Å²	41.5	42%	0.416	24%	0.244	S	C	.	.	S	Bend	trans	-58.1	-28.3	174.3	-26.2	34.5	0	0	0	113.6	W461 F463	P428-W461 HydrophobicContact CG-CB 3.86Å; P428-W461 HydrophobicContact CG-CG 4.41Å; P428-F463 HydrophobicContact CB-CE2 4.37Å; P428-F463 HydrophobicContact CB-CZ 3.74Å; P428-F463 HydrophobicContact CG-CE2 4.25Å; P428-F463 HydrophobicContact CG-CZ 3.99Å
429	V	93.7	Very high	93.8	Very high	43 Å²	43	36.9 Å²	36.9	26%	0.261	22%	0.222	S	C	.	.	S	Bend	trans	-129.5	139.8	-178	-175.3	0	0	0	0	109.4	M427 M431 F450	M427-V429 WeakPolarHBondContact CB-O 3.28Å; M427-V429 PolarHBondContact O-N 3.46Å; V429-M431 HydrophobicContact CB-CE 4.19Å; V429-F450 HydrophobicContact CG1-CD2 4.29Å; V429-F450 HydrophobicContact CG1-CE2 4.02Å; V429-F450 HydrophobicContact CG1-CZ 4.25Å; V429-F450 HydrophobicContact CG2-CD1 4.11Å; V429-F450 HydrophobicContact CG2-CE1 3.91Å; V429-F450 HydrophobicContact CG2-CZ 4.19Å
430	A	93	Very high	94	Very high	46 Å²	46	40.7 Å²	40.7	38%	0.38	24%	0.237	S	C	.	.			trans	-72.2	132.2	174.3	0	0	0	0	0	110.5	K409	K409-A430 HydrophobicContact CB-CB 4.19Å
431	M	91.9	Very high	94.1	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-132.4	131.3	-168.1	-73.9	-166.4	-172.1	0	0	113	G397 L408 M427 V429 H434 V445 Q447 F450 L452	G397-M431 PolarHBondContact N-O 2.66Å; G397-M431 VanDerWaalsContact N-O 3.11Å; L408-M431 PolarHBondContact O-N 2.81Å; L408-M431 VanDerWaalsContact O-N 3.09Å; M427-M431 HydrophobicContact CE-CB 3.87Å; M427-M431 HydrophobicContact CE-CG 4.4Å; M427-M431 HydrophobicContact SD-CB 4.34Å; M427-M431 HydrophobicContact SD-CG 4.43Å; M427-M431 HydrophobicContact SD-SD 4.2Å; V429-M431 HydrophobicContact CB-CE 4.19Å; M431-H434 HydrophobicContact CB-CB 4.11Å; M431-H434 PolarHBondContact O-ND1 3.49Å; M431-H434 HydrophobicContact SD-CB 4.28Å; M431-V445 HydrophobicContact SD-CG1 3.7Å; M431-Q447 HydrophobicContact CG-CB 4.48Å; M431-Q447 HydrophobicContact SD-CB 3.98Å; M431-F450 HydrophobicContact CE-CB 3.44Å; M431-F450 VanDerWaalsContact CE-CB 3.44Å; M431-F450 HydrophobicContact CE-CD2 4.42Å; M431-F450 HydrophobicContact CE-CG 4.07Å; M431-L452 HydrophobicContact CE-CD1 3.4Å; M431-L452 HydrophobicContact CE-CG 3.98Å; M431-L452 HydrophobicContact SD-CD1 4.39Å
432	E	88.2	Confident	94	Very high	37 Å²	37	46.1 Å²	46.1	17%	0.173	26%	0.257	C	S	.	.	S	Bend	trans	-130.2	147.8	171.7	65	167.6	-148	0	0	110	R405 S407 H434 Q447	R405-E432 IonicContact CZ-OE1 3.67Å; R405-E432 IonicContact CZ-OE2 3.63Å; R405-E432 IonicContact NE-OE1 2.69Å; R405-E432 PolarHBondContact NE-OE1 3.32Å; R405-E432 IonicContact NE-OE2 3.3Å; R405-E432 PolarHBondContact NE-OE2 3.33Å; R405-E432 IonicContact NH1-OE1 3.51Å; R405-E432 IonicContact NH2-OE1 3.95Å; R405-E432 PolarHBondContact NH2-OE1 2.73Å; R405-E432 IonicContact NH2-OE2 2.71Å; R405-E432 PolarHBondContact NH2-OE2 3.28Å; S407-E432 WeakPolarHBondContact OG-CG 3.44Å; S407-E432 PolarHBondContact OG-OE2 2.88Å; E432-H434 PolarHBondContact O-N 3.19Å; E432-Q447 PolarHBondContact O-NE2 3.42Å; E432-Q447 PolarHBondContact O-OE1 3.03Å; E432-Q447 VanDerWaalsContact O-OE1 3.09Å
433	F	83.8	Confident	94.1	Very high	63 Å²	63	43.1 Å²	43.1	28%	0.276	24%	0.239	S	C	.	.	S	Bend	trans	57.5	24.1	-172.6	-46.6	-62.8	0	0	0	114.6	Q473	F433-Q473 HydrophobicContact CB-CG 3.74Å; F433-Q473 HydrophobicContact CD1-CG 4.2Å; F433-Q473 HydrophobicContact CD2-CG 4.32Å; F433-Q473 HydrophobicContact CG-CG 3.88Å
434	H	91.4	Very high	94.1	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.009	21%	0.209	C	C	.	.			trans	-76.2	163.2	171.7	64.8	-85.6	0	0	0	110.5	K384 I395 M431 E432 V445 L446 Q447	K384-H434 WeakPolarHBondContact CE-O 3Å; K384-H434 WeakPolarHBondContact CG-O 3.47Å; I395-H434 PolarHBondContact O-CE1 2.91Å; I395-H434 PolarHBondContact O-NE2 2.89Å; I395-H434 VanDerWaalsContact O-NE2 3.14Å; M431-H434 HydrophobicContact CB-CB 4.11Å; M431-H434 PolarHBondContact O-ND1 3.49Å; M431-H434 HydrophobicContact SD-CB 4.28Å; E432-H434 PolarHBondContact O-N 3.19Å; H434-V445 HydrophobicContact CB-CG1 4.1Å; H434-L446 WeakPolarHBondContact CA-O 3.34Å; H434-Q447 HydrophobicContact CB-CB 3.84Å; H434-Q447 HydrophobicContact CB-CG 4.44Å
435	N	93.4	Very high	94	Very high	14 Å²	14	37.2 Å²	37.2	8%	0.075	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	149.5	162.8	-70.3	-82.7	0	0	0	109.5	V445 L446 G474 A476	N435-V445 CarbonylContact O-C 3.51Å; N435-V445 WeakPolarHBondContact O-CA 3.23Å; N435-L446 PolarHBondContact N-O 2.79Å; N435-L446 PolarHBondContact O-N 2.8Å; N435-G474 PolarHBondContact ND2-O 3.03Å; N435-A476 HydrophobicContact CB-CB 3.56Å
436	A	95.3	Very high	93.9	Very high	16 Å²	16	34.9 Å²	34.9	13%	0.132	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.5	174.7	0	0	0	0	0	108.7	K384 V386 I395 I443 Y444 V445	K384-A436 HydrophobicContact CB-CB 3.79Å; K384-A436 HydrophobicContact CG-CB 4.39Å; V386-A436 HydrophobicContact CG2-CB 3.48Å; V386-A436 VanDerWaalsContact CG2-CB 3.48Å; I395-A436 HydrophobicContact CD1-CB 3.93Å; A436-I443 HydrophobicContact CB-CG2 4.44Å; A436-Y444 CarbonylContact C-O 3.58Å; A436-Y444 VanDerWaalsContact CA-O 3.25Å; A436-Y444 WeakPolarHBondContact CA-O 3.47Å; A436-V445 HydrophobicContact CB-CG2 4.04Å
437	V	95.5	Very high	93.6	Very high	16 Å²	16	34.6 Å²	34.6	10%	0.097	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.9	179.1	-62.3	0	0	0	0	109.7	Y444 A476 V478 I483	V437-Y444 PolarHBondContact N-O 3.02Å; V437-Y444 PolarHBondContact O-N 3.1Å; V437-A476 HydrophobicContact CG1-CB 3.95Å; V437-V478 HydrophobicContact CB-CG2 4.03Å; V437-V478 HydrophobicContact CG2-CG2 3.95Å; V437-I483 HydrophobicContact CG2-CD1 4.07Å; V437-I483 HydrophobicContact CG2-CG1 4.07Å; V437-I483 HydrophobicContact CG2-CG2 4.18Å
438	E	95.6	Very high	93.1	Very high	74 Å²	74	35.1 Å²	35.1	35%	0.346	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.3	171.6	-176.7	-82.6	150	0	0	110	V386 Y387 C388 K440 E441 K442 V478	V386-E438 HydrophobicContact CG1-CB 3.67Å; Y387-E438 WeakPolarHBondContact O-CB 3.48Å; Y387-E438 WeakPolarHBondContact O-CG 3.47Å; C388-E438 HydrophobicContact CB-CG 3.85Å; E438-K440 PolarHBondContact OE1-N 2.97Å; E438-E441 PolarHBondContact OE1-N 2.74Å; E438-K442 WeakPolarHBondContact CA-O 2.99Å; E438-V478 WeakPolarHBondContact O-CG2 3.07Å
439	Y	94.7	Very high	92.8	Very high	16 Å²	16	38.6 Å²	38.6	6%	0.063	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	132.6	167.2	179.4	-104	0	0	0	111.1	E441 K442 Y444 V478 D481 I504	Y439-E441 VanDerWaalsContact C-N 3.29Å; Y439-E441 PolarHBondContact O-N 2.87Å; Y439-K442 PolarHBondContact N-O 2.78Å; Y439-K442 PolarHBondContact O-N 2.67Å; Y439-K442 VanDerWaalsContact O-N 3.09Å; Y439-Y444 HydrophobicContact CD1-CE2 4.41Å; Y439-Y444 WeakPolarHBondContact O-CE2 3.28Å; Y439-V478 HydrophobicContact CD2-CG1 3.59Å; Y439-V478 HydrophobicContact CE2-CG1 4.19Å; Y439-V478 HydrophobicContact CG-CG1 4.4Å; Y439-D481 HydrophobicContact CE2-CB 4.39Å; Y439-D481 WeakPolarHBondContact CE2-OD1 3.4Å; Y439-D481 WeakPolarHBondContact OH-CA 3.47Å; Y439-D481 VanDerWaalsContact OH-CB 3.23Å; Y439-D481 WeakPolarHBondContact OH-CB 3.1Å; Y439-D481 VanDerWaalsContact OH-CG 3.32Å; Y439-D481 PolarHBondContact OH-OD1 2.68Å; Y439-I504 HydrophobicContact CD1-CD1 3.07Å; Y439-I504 HydrophobicContact CD1-CG1 4.41Å; Y439-I504 HydrophobicContact CE1-CB 4.4Å; Y439-I504 HydrophobicContact CE1-CD1 3.41Å; Y439-I504 VanDerWaalsContact CE1-CD1 3.41Å; Y439-I504 HydrophobicContact CE1-CG1 4.47Å; Y439-I504 HydrophobicContact CG-CD1 3.78Å
440	K	92.1	Very high	92.8	Very high	111 Å²	111	40.7 Å²	40.7	48%	0.483	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	52.4	178.5	-71.9	-177.7	175.6	160	0	111.6	E438 K442 E505	E438-K440 PolarHBondContact OE1-N 2.97Å; K440-K442 PolarHBondContact O-N 2.84Å; K440-E505 IonicContact NZ-OE1 3.46Å; K440-E505 PolarHBondContact NZ-OE1 2.9Å
441	E	94.1	Very high	92.8	Very high	113 Å²	113	38.7 Å²	38.7	53%	0.528	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	18.5	175.4	-60.9	-178.8	-173.8	0	0	115	C389 E438 Y439 P456 Q457	C389-E441 VanDerWaalsContact SG-CB 3.59Å; E438-E441 PolarHBondContact OE1-N 2.74Å; Y439-E441 VanDerWaalsContact C-N 3.29Å; Y439-E441 PolarHBondContact O-N 2.87Å; E441-P456 WeakPolarHBondContact O-CD 3.47Å; E441-Q457 PolarHBondContact OE2-NE2 3.25Å
442	K	95.8	Very high	93	Very high	64 Å²	64	38.6 Å²	38.6	28%	0.278	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.5	175	-61.2	-171.1	-172.6	-167.6	0	110.6	E438 Y439 K440 Y444 F453 Y454 E455	E438-K442 WeakPolarHBondContact CA-O 2.99Å; Y439-K442 PolarHBondContact N-O 2.78Å; Y439-K442 PolarHBondContact O-N 2.67Å; Y439-K442 VanDerWaalsContact O-N 3.09Å; K440-K442 PolarHBondContact O-N 2.84Å; K442-Y444 HydrophobicContact CB-CE2 3.75Å; K442-F453 HydrophobicContact CD-CD2 4.3Å; K442-Y454 WeakPolarHBondContact CA-O 3.46Å; K442-E455 HydrophobicContact CD-CG 3.76Å; K442-E455 HydrophobicContact CG-CG 4.1Å; K442-E455 VanDerWaalsContact NZ-CD 3.34Å; K442-E455 IonicContact NZ-OE1 2.8Å; K442-E455 PolarHBondContact NZ-OE1 3.46Å; K442-E455 IonicContact NZ-OE2 3.15Å
443	I	97.5	Very high	93.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.9	176.5	-58.5	169.4	0	0	0	109.2	V386 C388 Y393 I395 A436 V445 F453 Y454	V386-I443 HydrophobicContact CB-CD1 4.43Å; V386-I443 HydrophobicContact CB-CG2 4.46Å; V386-I443 HydrophobicContact CG1-CD1 4.21Å; V386-I443 HydrophobicContact CG1-CG1 3.96Å; V386-I443 HydrophobicContact CG1-CG2 4.19Å; V386-I443 HydrophobicContact CG2-CG2 4.31Å; C388-I443 HydrophobicContact CB-CD1 3.74Å; C388-I443 HydrophobicContact CB-CG1 3.67Å; Y393-I443 HydrophobicContact CD1-CD1 4.11Å; Y393-I443 HydrophobicContact CD2-CD1 3.49Å; Y393-I443 VanDerWaalsContact CD2-CD1 3.49Å; Y393-I443 HydrophobicContact CE2-CD1 4.04Å; Y393-I443 HydrophobicContact CG-CD1 3.54Å; I395-I443 HydrophobicContact CD1-CD1 4.48Å; I395-I443 HydrophobicContact CD1-CG2 3.6Å; A436-I443 HydrophobicContact CB-CG2 4.44Å; I443-V445 HydrophobicContact CG2-CG2 4.21Å; I443-F453 CarbonylContact O-C 3.56Å; I443-F453 VanDerWaalsContact O-CA 3.23Å; I443-F453 WeakPolarHBondContact O-CA 3.46Å; I443-Y454 HydrophobicContact CD1-CD1 4.13Å; I443-Y454 PolarHBondContact N-O 2.93Å; I443-Y454 PolarHBondContact O-N 3.13Å
444	Y	96.4	Very high	94	Very high	12 Å²	12	35.5 Å²	35.5	5%	0.047	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.6	-177.7	-68.1	-88.5	0	0	0	109.4	A436 V437 Y439 K442 F451 L452 F453 L464 I483 I504	A436-Y444 CarbonylContact C-O 3.58Å; A436-Y444 VanDerWaalsContact CA-O 3.25Å; A436-Y444 WeakPolarHBondContact CA-O 3.47Å; V437-Y444 PolarHBondContact N-O 3.02Å; V437-Y444 PolarHBondContact O-N 3.1Å; Y439-Y444 HydrophobicContact CD1-CE2 4.41Å; Y439-Y444 WeakPolarHBondContact O-CE2 3.28Å; K442-Y444 HydrophobicContact CB-CE2 3.75Å; Y444-F451 AromaticContact CD1-CE2 3.96Å; Y444-F451 HydrophobicContact CD1-CE2 3.96Å; Y444-F451 HydrophobicContact CD1-CZ 4.07Å; Y444-F451 HydrophobicContact CG-CE2 4.44Å; Y444-L452 CarbonylContact C-O 3.58Å; Y444-L452 WeakPolarHBondContact CA-O 3.22Å; Y444-F453 HydrophobicContact CD1-CB 3.87Å; Y444-F453 HydrophobicContact CE1-CB 3.85Å; Y444-L464 HydrophobicContact CD1-CD1 3.65Å; Y444-L464 HydrophobicContact CE1-CD1 3.73Å; Y444-I483 HydrophobicContact CD1-CD1 3.85Å; Y444-I483 HydrophobicContact CD2-CD1 3.92Å; Y444-I483 HydrophobicContact CE1-CD1 4.45Å; Y444-I483 HydrophobicContact CG-CD1 3.55Å; Y444-I504 HydrophobicContact CE1-CD1 4.45Å; Y444-I504 HydrophobicContact CE2-CD1 4.29Å
445	V	96.1	Very high	94.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.7	-176.4	-175.8	0	0	0	0	110.3	I395 M427 M431 H434 N435 A436 I443 L452 W461	I395-V445 HydrophobicContact CD1-CG2 4.23Å; I395-V445 HydrophobicContact CG2-CG2 4.14Å; M427-V445 HydrophobicContact SD-CG1 4.18Å; M431-V445 HydrophobicContact SD-CG1 3.7Å; H434-V445 HydrophobicContact CB-CG1 4.1Å; N435-V445 CarbonylContact O-C 3.51Å; N435-V445 WeakPolarHBondContact O-CA 3.23Å; A436-V445 HydrophobicContact CB-CG2 4.04Å; I443-V445 HydrophobicContact CG2-CG2 4.21Å; V445-L452 HydrophobicContact CB-CB 4.47Å; V445-L452 PolarHBondContact N-O 2.94Å; V445-L452 PolarHBondContact O-N 3.01Å; V445-W461 HydrophobicContact CB-CZ3 4.24Å; V445-W461 HydrophobicContact CG2-CH2 3.71Å; V445-W461 HydrophobicContact CG2-CZ3 3.74Å
446	L	93.6	Very high	94.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126	-173.6	-54.4	100.8	0	0	0	111.5	H434 N435 F451 A476 I483 Y485 W509	H434-L446 WeakPolarHBondContact CA-O 3.34Å; N435-L446 PolarHBondContact N-O 2.79Å; N435-L446 PolarHBondContact O-N 2.8Å; L446-F451 HydrophobicContact CD1-CD2 4.34Å; L446-F451 HydrophobicContact CD1-CE2 3.93Å; L446-F451 HydrophobicContact CD2-CD1 4.23Å; L446-F451 HydrophobicContact CD2-CD2 3.59Å; L446-F451 HydrophobicContact CD2-CE1 4.18Å; L446-F451 HydrophobicContact CD2-CE2 3.52Å; L446-F451 HydrophobicContact CD2-CG 3.95Å; L446-F451 HydrophobicContact CD2-CZ 3.84Å; L446-F451 HydrophobicContact CG-CD2 3.48Å; L446-F451 VanDerWaalsContact CG-CD2 3.48Å; L446-F451 HydrophobicContact CG-CE2 3.53Å; L446-F451 HydrophobicContact CG-CG 4.25Å; L446-F451 HydrophobicContact CG-CZ 4.33Å; L446-A476 HydrophobicContact CD1-CB 4.24Å; L446-I483 HydrophobicContact CD1-CG2 4.37Å; L446-Y485 HydrophobicContact CB-CD2 4.05Å; L446-Y485 HydrophobicContact CB-CE2 3.78Å; L446-Y485 HydrophobicContact CD2-CD2 4.01Å; L446-Y485 HydrophobicContact CG-CD2 4.45Å; L446-W509 HydrophobicContact CD2-CH2 3.63Å; L446-W509 HydrophobicContact CD2-CZ2 3.78Å
447	Q	90.6	Very high	94.3	Very high	32 Å²	32	43.8 Å²	43.8	15%	0.15	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	121.2	170.4	-174.6	-173.5	-19.8	0	0	111.5	M431 E432 H434 E449 F450 I472	M431-Q447 HydrophobicContact CG-CB 4.48Å; M431-Q447 HydrophobicContact SD-CB 3.98Å; E432-Q447 PolarHBondContact O-NE2 3.42Å; E432-Q447 PolarHBondContact O-OE1 3.03Å; E432-Q447 VanDerWaalsContact O-OE1 3.09Å; H434-Q447 HydrophobicContact CB-CB 3.84Å; H434-Q447 HydrophobicContact CB-CG 4.44Å; Q447-E449 PolarHBondContact O-N 3.48Å; Q447-F450 PolarHBondContact N-O 3.14Å; Q447-F450 PolarHBondContact O-N 3.48Å; Q447-I472 HydrophobicContact CG-CG2 3.92Å
448	G	87.5	Confident	94.3	Very high	13 Å²	13	49.8 Å²	49.8	13%	0.134	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	62.4	-119.6	173.1	0	0	0	0	0	111.3	M467 P470 R471	G448-M467 WeakPolarHBondContact O-CE 3.19Å; G448-P470 WeakPolarHBondContact O-CA 3.39Å; G448-R471 VanDerWaalsContact CA-O 3.3Å; G448-R471 WeakPolarHBondContact CA-O 3.42Å; G448-R471 PolarHBondContact N-O 3.3Å
449	E	88.8	Confident	94.4	Very high	137 Å²	137	49.8 Å²	49.8	64%	0.64	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-9.1	175.9	-65.7	-173	157	0	0	113.1	Q447 P466 P470	Q447-E449 PolarHBondContact O-N 3.48Å; E449-P466 WeakPolarHBondContact O-CB 3.33Å; E449-P470 HydrophobicContact CG-CB 3.51Å; E449-P470 HydrophobicContact CG-CG 3.6Å
450	F	92.6	Very high	94.4	Very high	87 Å²	87	55.2 Å²	55.2	38%	0.382	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	122.1	-176.2	-58.1	-71.6	0	0	0	110.7	V429 M431 Q447	V429-F450 HydrophobicContact CG1-CD2 4.29Å; V429-F450 HydrophobicContact CG1-CE2 4.02Å; V429-F450 HydrophobicContact CG1-CZ 4.25Å; V429-F450 HydrophobicContact CG2-CD1 4.11Å; V429-F450 HydrophobicContact CG2-CE1 3.91Å; V429-F450 HydrophobicContact CG2-CZ 4.19Å; M431-F450 HydrophobicContact CE-CB 3.44Å; M431-F450 VanDerWaalsContact CE-CB 3.44Å; M431-F450 HydrophobicContact CE-CD2 4.42Å; M431-F450 HydrophobicContact CE-CG 4.07Å; Q447-F450 PolarHBondContact N-O 3.14Å; Q447-F450 PolarHBondContact O-N 3.48Å
451	F	94.3	Very high	94.7	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.018	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.2	166.4	-171.6	-169.5	0	0	0	109.2	Y444 L446 L464 T465 I483 Y502 W509	Y444-F451 AromaticContact CD1-CE2 3.96Å; Y444-F451 HydrophobicContact CD1-CE2 3.96Å; Y444-F451 HydrophobicContact CD1-CZ 4.07Å; Y444-F451 HydrophobicContact CG-CE2 4.44Å; L446-F451 HydrophobicContact CD1-CD2 4.34Å; L446-F451 HydrophobicContact CD1-CE2 3.93Å; L446-F451 HydrophobicContact CD2-CD1 4.23Å; L446-F451 HydrophobicContact CD2-CD2 3.59Å; L446-F451 HydrophobicContact CD2-CE1 4.18Å; L446-F451 HydrophobicContact CD2-CE2 3.52Å; L446-F451 HydrophobicContact CD2-CG 3.95Å; L446-F451 HydrophobicContact CD2-CZ 3.84Å; L446-F451 HydrophobicContact CG-CD2 3.48Å; L446-F451 VanDerWaalsContact CG-CD2 3.48Å; L446-F451 HydrophobicContact CG-CE2 3.53Å; L446-F451 HydrophobicContact CG-CG 4.25Å; L446-F451 HydrophobicContact CG-CZ 4.33Å; F451-L464 HydrophobicContact CB-CB 4.21Å; F451-L464 HydrophobicContact CD1-CB 3.58Å; F451-L464 HydrophobicContact CD1-CD1 4.02Å; F451-L464 HydrophobicContact CD1-CG 4.45Å; F451-L464 HydrophobicContact CD2-CB 4.44Å; F451-L464 HydrophobicContact CD2-CD1 4.05Å; F451-L464 HydrophobicContact CE1-CB 4.04Å; F451-L464 HydrophobicContact CE1-CD1 3.71Å; F451-L464 HydrophobicContact CE2-CD1 3.75Å; F451-L464 HydrophobicContact CG-CB 3.82Å; F451-L464 HydrophobicContact CG-CD1 4.2Å; F451-L464 HydrophobicContact CZ-CD1 3.58Å; F451-L464 PolarHBondContact O-N 2.99Å; F451-T465 WeakPolarHBondContact CD1-O 3.31Å; F451-I483 HydrophobicContact CZ-CD1 4.04Å; F451-Y502 HydrophobicContact CD1-CE2 4.42Å; F451-Y502 AromaticContact CE1-CD1 3.57Å; F451-Y502 HydrophobicContact CE1-CD1 3.57Å; F451-Y502 AromaticContact CE1-CD2 3.86Å; F451-Y502 HydrophobicContact CE1-CD2 3.86Å; F451-Y502 AromaticContact CE1-CE1 3.51Å; F451-Y502 HydrophobicContact CE1-CE1 3.51Å; F451-Y502 AromaticContact CE1-CE2 3.81Å; F451-Y502 HydrophobicContact CE1-CE2 3.81Å; F451-Y502 AromaticContact CE1-CG 3.72Å; F451-Y502 HydrophobicContact CE1-CG 3.72Å; F451-Y502 AromaticContact CE1-CZ 3.64Å; F451-Y502 AromaticContact CZ-CD1 3.8Å; F451-Y502 HydrophobicContact CZ-CD1 3.8Å; F451-Y502 AromaticContact CZ-CE1 3.84Å; F451-Y502 HydrophobicContact CZ-CE1 3.84Å; F451-Y502 HydrophobicContact CZ-CG 4.29Å; F451-W509 AromaticContact CD1-CZ2 3.66Å; F451-W509 HydrophobicContact CD1-CZ2 3.66Å; F451-W509 HydrophobicContact CE1-CH2 4.43Å; F451-W509 AromaticContact CE1-CZ2 3.58Å; F451-W509 HydrophobicContact CE1-CZ2 3.58Å; F451-W509 HydrophobicContact CZ-CZ2 4.36Å
452	L	95.6	Very high	94.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	151.5	-175.7	-53.9	177.9	0	0	0	110.8	M431 Y444 V445 W461 G462 F463	M431-L452 HydrophobicContact CE-CD1 3.4Å; M431-L452 HydrophobicContact CE-CG 3.98Å; M431-L452 HydrophobicContact SD-CD1 4.39Å; Y444-L452 CarbonylContact C-O 3.58Å; Y444-L452 WeakPolarHBondContact CA-O 3.22Å; V445-L452 HydrophobicContact CB-CB 4.47Å; V445-L452 PolarHBondContact N-O 2.94Å; V445-L452 PolarHBondContact O-N 3.01Å; L452-W461 HydrophobicContact CB-CE3 3.82Å; L452-W461 HydrophobicContact CB-CZ3 3.97Å; L452-W461 HydrophobicContact CD1-CE3 4.21Å; L452-W461 HydrophobicContact CD1-CZ3 4.44Å; L452-G462 VanDerWaalsContact CA-O 3.3Å; L452-G462 WeakPolarHBondContact CA-O 3.21Å; L452-F463 HydrophobicContact CD2-CD1 3.33Å; L452-F463 HydrophobicContact CD2-CE1 3.4Å; L452-F463 HydrophobicContact CD2-CG 3.98Å; L452-F463 HydrophobicContact CD2-CZ 4.08Å
453	F	96.1	Very high	94.7	Very high	31 Å²	31	48.3 Å²	48.3	14%	0.136	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	150.6	162.3	73.3	-86.7	0	0	0	110.4	K442 I443 Y444 E455 Y460 W461 G462 L464	K442-F453 HydrophobicContact CD-CD2 4.3Å; I443-F453 CarbonylContact O-C 3.56Å; I443-F453 VanDerWaalsContact O-CA 3.23Å; I443-F453 WeakPolarHBondContact O-CA 3.46Å; Y444-F453 HydrophobicContact CD1-CB 3.87Å; Y444-F453 HydrophobicContact CE1-CB 3.85Å; F453-E455 HydrophobicContact CD2-CG 4.03Å; F453-E455 HydrophobicContact CE2-CG 3.9Å; F453-E455 VanDerWaalsContact CE2-OE1 3.28Å; F453-E455 WeakPolarHBondContact CE2-OE1 3.37Å; F453-Y460 HydrophobicContact CE2-CE1 4.46Å; F453-Y460 HydrophobicContact CZ-CE1 4.3Å; F453-W461 CarbonylContact O-C 3.49Å; F453-W461 WeakPolarHBondContact O-CA 3.31Å; F453-G462 VanDerWaalsContact CE1-CA 3.44Å; F453-G462 PolarHBondContact N-O 3.25Å; F453-G462 PolarHBondContact O-N 3.39Å; F453-L464 HydrophobicContact CB-CD1 4.2Å; F453-L464 HydrophobicContact CD1-CD1 4.22Å; F453-L464 HydrophobicContact CD1-CD2 3.75Å; F453-L464 HydrophobicContact CD1-CG 3.77Å; F453-L464 HydrophobicContact CE1-CD2 4.11Å
454	Y	97.7	Very high	94.5	Very high	3 Å²	3	50.1 Å²	50.1	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.7	175.1	177.1	-111	0	0	0	109.2	Y393 V424 C425 K442 I443 P456 D459 Y460 W461	Y393-Y454 HydrophobicContact CD1-CE1 4.19Å; Y393-Y454 AromaticContact CE1-CE1 3.74Å; Y393-Y454 HydrophobicContact CE1-CE1 3.74Å; V424-Y454 WeakPolarHBondContact CB-OH 3.41Å; C425-Y454 HydrophobicContact CB-CE2 4.43Å; K442-Y454 WeakPolarHBondContact CA-O 3.46Å; I443-Y454 HydrophobicContact CD1-CD1 4.13Å; I443-Y454 PolarHBondContact N-O 2.93Å; I443-Y454 PolarHBondContact O-N 3.13Å; Y454-P456 HydrophobicContact CD1-CG 3.92Å; Y454-P456 HydrophobicContact CE1-CB 4.08Å; Y454-P456 HydrophobicContact CE1-CG 3.83Å; Y454-P456 WeakPolarHBondContact O-CD 3.42Å; Y454-D459 PolarHBondContact OH-OD1 2.9Å; Y454-Y460 WeakPolarHBondContact CA-O 3.38Å; Y454-Y460 WeakPolarHBondContact CD2-O 3.48Å; Y454-W461 AromaticContact CD2-CD1 3.81Å; Y454-W461 AromaticContact CD2-CD2 3.83Å; Y454-W461 HydrophobicContact CD2-CD2 3.83Å; Y454-W461 AromaticContact CD2-CE2 3.39Å; Y454-W461 HydrophobicContact CD2-CG 4.05Å; Y454-W461 HydrophobicContact CD2-CH2 4.5Å; Y454-W461 AromaticContact CD2-CZ2 3.75Å; Y454-W461 HydrophobicContact CD2-CZ2 3.75Å; Y454-W461 AromaticContact CD2-NE1 3.39Å; Y454-W461 AromaticContact CE2-NE1 3.81Å; Y454-W461 HydrophobicContact CG-CD2 4.25Å; Y454-W461 AromaticContact CG-CE2 3.84Å; Y454-W461 HydrophobicContact CG-CH2 4.12Å; Y454-W461 AromaticContact CG-CZ2 3.74Å; Y454-W461 HydrophobicContact CG-CZ2 3.74Å
455	E	96.9	Very high	94.1	Very high	29 Å²	29	52.3 Å²	52.3	14%	0.136	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	100.9	172.8	-75	-174.8	-148.2	0	0	109.3	K442 F453 Q457 K458 D459 Y460	K442-E455 HydrophobicContact CD-CG 3.76Å; K442-E455 HydrophobicContact CG-CG 4.1Å; K442-E455 VanDerWaalsContact NZ-CD 3.34Å; K442-E455 IonicContact NZ-OE1 2.8Å; K442-E455 PolarHBondContact NZ-OE1 3.46Å; K442-E455 IonicContact NZ-OE2 3.15Å; F453-E455 HydrophobicContact CD2-CG 4.03Å; F453-E455 HydrophobicContact CE2-CG 3.9Å; F453-E455 VanDerWaalsContact CE2-OE1 3.28Å; F453-E455 WeakPolarHBondContact CE2-OE1 3.37Å; E455-Q457 VanDerWaalsContact C-N 3.26Å; E455-Q457 PolarHBondContact O-N 2.91Å; E455-K458 HydrophobicContact CB-CB 4.35Å; E455-K458 PolarHBondContact O-N 2.87Å; E455-K458 VanDerWaalsContact O-N 3.09Å; E455-K458 WeakPolarHBondContact OE2-CD 3.21Å; E455-K458 WeakPolarHBondContact OE2-CE 3.48Å; E455-K458 IonicContact OE2-NZ 3.88Å; E455-K458 PolarHBondContact OE2-NZ 2.84Å; E455-D459 PolarHBondContact O-N 3.23Å; E455-Y460 PolarHBondContact N-O 2.72Å; E455-Y460 PolarHBondContact O-N 3.07Å
456	P	95.5	Very high	93.8	Very high	20 Å²	20	55.5 Å²	55.5	13%	0.13	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-53.7	-38.3	-178.5	-31.2	38.4	0	0	0	114.9	Y393 E441 Y454 K458 D459	Y393-P456 WeakPolarHBondContact OH-CB 3.34Å; E441-P456 WeakPolarHBondContact O-CD 3.47Å; Y454-P456 HydrophobicContact CD1-CG 3.92Å; Y454-P456 HydrophobicContact CE1-CB 4.08Å; Y454-P456 HydrophobicContact CE1-CG 3.83Å; Y454-P456 WeakPolarHBondContact O-CD 3.42Å; P456-K458 VanDerWaalsContact C-N 3.26Å; P456-K458 PolarHBondContact O-N 2.94Å; P456-D459 PolarHBondContact O-N 3.35Å
457	Q	93.9	Very high	93.6	Very high	158 Å²	158	55.9 Å²	55.9	74%	0.738	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-66.8	-26.7	-178.1	-63.7	179.9	4.1	0	0	113.4	E441 E455	E441-Q457 PolarHBondContact OE2-NE2 3.25Å; E455-Q457 VanDerWaalsContact C-N 3.26Å; E455-Q457 PolarHBondContact O-N 2.91Å
458	K	95.3	Very high	93.5	Very high	141 Å²	141	59.2 Å²	59.2	61%	0.613	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-106.3	-5.2	-178.9	-65.3	-179.6	-171.7	148.6	0	113.1	E455 P456 Y460	E455-K458 HydrophobicContact CB-CB 4.35Å; E455-K458 PolarHBondContact O-N 2.87Å; E455-K458 VanDerWaalsContact O-N 3.09Å; E455-K458 WeakPolarHBondContact OE2-CD 3.21Å; E455-K458 WeakPolarHBondContact OE2-CE 3.48Å; E455-K458 IonicContact OE2-NZ 3.88Å; E455-K458 PolarHBondContact OE2-NZ 2.84Å; P456-K458 VanDerWaalsContact C-N 3.26Å; P456-K458 PolarHBondContact O-N 2.94Å; K458-Y460 VanDerWaalsContact C-N 3.25Å; K458-Y460 PolarHBondContact O-N 2.57Å
459	D	96.4	Very high	93.4	Very high	75 Å²	75	60.9 Å²	60.9	40%	0.401	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	48.2	-171.5	-166.4	24.5	0	0	0	112.3	C425 Y454 E455 P456	C425-D459 WeakPolarHBondContact CA-OD1 3.49Å; C425-D459 VanDerWaalsContact CB-CG 3.42Å; C425-D459 VanDerWaalsContact CB-O 3.23Å; C425-D459 WeakPolarHBondContact CB-O 3.11Å; C425-D459 WeakPolarHBondContact CB-OD1 3.3Å; C425-D459 PolarHBondContact N-OD1 2.81Å; C425-D459 PolarHBondContact N-OD2 3.44Å; Y454-D459 PolarHBondContact OH-OD1 2.9Å; E455-D459 PolarHBondContact O-N 3.23Å; P456-D459 PolarHBondContact O-N 3.35Å
460	Y	96.6	Very high	93.4	Very high	130 Å²	130	56.4 Å²	56.4	51%	0.51	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.8	-167.9	172.6	-96.1	0	0	0	112.8	F453 Y454 E455 K458	F453-Y460 HydrophobicContact CE2-CE1 4.46Å; F453-Y460 HydrophobicContact CZ-CE1 4.3Å; Y454-Y460 WeakPolarHBondContact CA-O 3.38Å; Y454-Y460 WeakPolarHBondContact CD2-O 3.48Å; E455-Y460 PolarHBondContact N-O 2.72Å; E455-Y460 PolarHBondContact O-N 3.07Å; K458-Y460 VanDerWaalsContact C-N 3.25Å; K458-Y460 PolarHBondContact O-N 2.57Å
461	W	97.6	Very high	93.2	Very high	14 Å²	14	52.4 Å²	52.4	5%	0.053	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.1	173.4	-71.5	93.8	0	0	0	111.8	V411 C425 M427 P428 V445 L452 F453 Y454	V411-W461 HydrophobicContact CG2-CZ2 3.92Å; C425-W461 PolarHBondContact O-NE1 3.34Å; M427-W461 HydrophobicContact CG-CD2 4.42Å; M427-W461 HydrophobicContact CG-CH2 3.79Å; M427-W461 HydrophobicContact CG-CZ2 3.66Å; M427-W461 HydrophobicContact CG-CZ3 4.23Å; M427-W461 HydrophobicContact SD-CH2 4.41Å; P428-W461 HydrophobicContact CG-CB 3.86Å; P428-W461 HydrophobicContact CG-CG 4.41Å; V445-W461 HydrophobicContact CB-CZ3 4.24Å; V445-W461 HydrophobicContact CG2-CH2 3.71Å; V445-W461 HydrophobicContact CG2-CZ3 3.74Å; L452-W461 HydrophobicContact CB-CE3 3.82Å; L452-W461 HydrophobicContact CB-CZ3 3.97Å; L452-W461 HydrophobicContact CD1-CE3 4.21Å; L452-W461 HydrophobicContact CD1-CZ3 4.44Å; F453-W461 CarbonylContact O-C 3.49Å; F453-W461 WeakPolarHBondContact O-CA 3.31Å; Y454-W461 AromaticContact CD2-CD1 3.81Å; Y454-W461 AromaticContact CD2-CD2 3.83Å; Y454-W461 HydrophobicContact CD2-CD2 3.83Å; Y454-W461 AromaticContact CD2-CE2 3.39Å; Y454-W461 HydrophobicContact CD2-CG 4.05Å; Y454-W461 HydrophobicContact CD2-CH2 4.5Å; Y454-W461 AromaticContact CD2-CZ2 3.75Å; Y454-W461 HydrophobicContact CD2-CZ2 3.75Å; Y454-W461 AromaticContact CD2-NE1 3.39Å; Y454-W461 AromaticContact CE2-NE1 3.81Å; Y454-W461 HydrophobicContact CG-CD2 4.25Å; Y454-W461 AromaticContact CG-CE2 3.84Å; Y454-W461 HydrophobicContact CG-CH2 4.12Å; Y454-W461 AromaticContact CG-CZ2 3.74Å; Y454-W461 HydrophobicContact CG-CZ2 3.74Å
462	G	95.1	Very high	93	Very high	2 Å²	2	55 Å²	55	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	165.9	170.6	0	0	0	0	0	112.8	L452 F453	L452-G462 VanDerWaalsContact CA-O 3.3Å; L452-G462 WeakPolarHBondContact CA-O 3.21Å; F453-G462 VanDerWaalsContact CE1-CA 3.44Å; F453-G462 PolarHBondContact N-O 3.25Å; F453-G462 PolarHBondContact O-N 3.39Å
463	F	94.5	Very high	92.6	Very high	127 Å²	127	59.6 Å²	59.6	56%	0.557	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.1	178.8	-66	-95	0	0	0	110.7	P428 L452	P428-F463 HydrophobicContact CB-CE2 4.37Å; P428-F463 HydrophobicContact CB-CZ 3.74Å; P428-F463 HydrophobicContact CG-CE2 4.25Å; P428-F463 HydrophobicContact CG-CZ 3.99Å; L452-F463 HydrophobicContact CD2-CD1 3.33Å; L452-F463 HydrophobicContact CD2-CE1 3.4Å; L452-F463 HydrophobicContact CD2-CG 3.98Å; L452-F463 HydrophobicContact CD2-CZ 4.08Å
464	L	92.9	Very high	92.2	Very high	37 Å²	37	58.3 Å²	58.3	19%	0.194	30%	0.295	C	S	.	.			trans	-117.1	172.6	174.6	-64.7	173.8	0	0	0	111.1	Y444 F451 F453 Y502	Y444-L464 HydrophobicContact CD1-CD1 3.65Å; Y444-L464 HydrophobicContact CE1-CD1 3.73Å; F451-L464 HydrophobicContact CB-CB 4.21Å; F451-L464 HydrophobicContact CD1-CB 3.58Å; F451-L464 HydrophobicContact CD1-CD1 4.02Å; F451-L464 HydrophobicContact CD1-CG 4.45Å; F451-L464 HydrophobicContact CD2-CB 4.44Å; F451-L464 HydrophobicContact CD2-CD1 4.05Å; F451-L464 HydrophobicContact CE1-CB 4.04Å; F451-L464 HydrophobicContact CE1-CD1 3.71Å; F451-L464 HydrophobicContact CE2-CD1 3.75Å; F451-L464 HydrophobicContact CG-CB 3.82Å; F451-L464 HydrophobicContact CG-CD1 4.2Å; F451-L464 HydrophobicContact CZ-CD1 3.58Å; F451-L464 PolarHBondContact O-N 2.99Å; F453-L464 HydrophobicContact CB-CD1 4.2Å; F453-L464 HydrophobicContact CD1-CD1 4.22Å; F453-L464 HydrophobicContact CD1-CD2 3.75Å; F453-L464 HydrophobicContact CD1-CG 3.77Å; F453-L464 HydrophobicContact CE1-CD2 4.11Å; L464-Y502 HydrophobicContact CD1-CE1 4.25Å
465	T	89.1	Confident	92	Very high	58 Å²	58	59 Å²	59	36%	0.356	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-61.5	122.8	176	-55.4	0	0	0	0	110.2	F451 N507 W509	F451-T465 WeakPolarHBondContact CD1-O 3.31Å; T465-N507 WeakPolarHBondContact CB-OD1 3.21Å; T465-N507 PolarHBondContact N-OD1 3.1Å; T465-N507 VanDerWaalsContact OG1-CG 3.29Å; T465-N507 PolarHBondContact OG1-ND2 3.32Å; T465-N507 PolarHBondContact OG1-O 3.44Å; T465-N507 PolarHBondContact OG1-OD1 3.05Å; T465-W509 PolarHBondContact O-NE1 2.82Å
466	P	89.5	Confident	91.9	Very high	68 Å²	68	58.4 Å²	58.4	44%	0.442	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-63	158.4	-178.2	28.4	-36.3	0	0	0	111.7	E449 W509	E449-P466 WeakPolarHBondContact O-CB 3.33Å; P466-W509 PolarHBondContact O-NE1 2.78Å
467	M	88.8	Confident	91.9	Very high	8 Å²	8	58 Å²	58	4%	0.039	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-56.5	145.3	173.2	-69.7	176.6	-69.3	0	0	110.7	G448 V469 R471 Y485 W509	G448-M467 WeakPolarHBondContact O-CE 3.19Å; M467-V469 PolarHBondContact O-N 3.4Å; M467-R471 HydrophobicContact CE-CG 4.45Å; M467-Y485 HydrophobicContact CE-CE2 4.41Å; M467-Y485 HydrophobicContact SD-CD1 3.71Å; M467-Y485 HydrophobicContact SD-CD2 3.84Å; M467-Y485 HydrophobicContact SD-CE1 3.86Å; M467-Y485 HydrophobicContact SD-CE2 3.98Å; M467-Y485 HydrophobicContact SD-CG 3.66Å; M467-W509 HydrophobicContact CB-CZ2 4.43Å; M467-W509 HydrophobicContact CG-CD2 4.36Å; M467-W509 HydrophobicContact CG-CH2 3.63Å; M467-W509 HydrophobicContact CG-CZ2 3.4Å; M467-W509 VanDerWaalsContact CG-CZ2 3.4Å; M467-W509 HydrophobicContact CG-CZ3 4.21Å; M467-W509 HydrophobicContact SD-CH2 4.35Å
468	T	88.6	Confident	91.9	Very high	102 Å²	102	52 Å²	52	63%	0.626	27%	0.271	S	S	*	.	S	Bend	trans	-58.4	-33.8	176.5	-29.5	0	0	0	0	111.4	E500	T468-E500 WeakPolarHBondContact CB-OE1 3Å; T468-E500 PolarHBondContact OG1-OE1 2.77Å
469	V	85.4	Confident	91.8	Very high	48 Å²	48	45.9 Å²	45.9	29%	0.291	24%	0.244	S	C	.	.	S	Bend	trans	-123.4	100.1	175.9	-166.4	0	0	0	0	110.1	M467 R471 M496	M467-V469 PolarHBondContact O-N 3.4Å; V469-R471 PolarHBondContact O-N 2.89Å; V469-R471 PolarHBondContact O-NH1 2.9Å; V469-M496 HydrophobicContact CB-CE 4.25Å; V469-M496 HydrophobicContact CG1-CE 3.34Å; V469-M496 HydrophobicContact CG1-SD 3.92Å
470	P	88.1	Confident	91.4	Very high	43 Å²	43	48 Å²	48	28%	0.279	25%	0.25	S	C	.	.			trans	-57.3	127.4	177.9	-27.6	36.3	0	0	0	112.6	G448 E449	G448-P470 WeakPolarHBondContact O-CA 3.39Å; E449-P470 HydrophobicContact CG-CB 3.51Å; E449-P470 HydrophobicContact CG-CG 3.6Å
471	R	89.9	Confident	91.1	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.008	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-155.5	152.8	-178.2	60.5	-169.7	178.5	-80.4	4.7	112.6	G448 M467 V469 Y485 A487 T489 M496 E500	G448-R471 VanDerWaalsContact CA-O 3.3Å; G448-R471 WeakPolarHBondContact CA-O 3.42Å; G448-R471 PolarHBondContact N-O 3.3Å; M467-R471 HydrophobicContact CE-CG 4.45Å; V469-R471 PolarHBondContact O-N 2.89Å; V469-R471 PolarHBondContact O-NH1 2.9Å; R471-Y485 HydrophobicContact CG-CD1 4.39Å; R471-Y485 HydrophobicContact CG-CE1 3.63Å; R471-Y485 VanDerWaalsContact CZ-CD1 3.44Å; R471-Y485 VanDerWaalsContact NE-CD1 3.3Å; R471-Y485 VanDerWaalsContact NE-CE1 3.34Å; R471-Y485 VanDerWaalsContact NH2-CD1 3.3Å; R471-Y485 PolarHBondContact NH2-O 3.36Å; R471-Y485 PolarHBondContact O-OH 2.96Å; R471-A487 WeakPolarHBondContact CD-O 3.34Å; R471-A487 PolarHBondContact NE-O 2.71Å; R471-T489 WeakPolarHBondContact CA-O 2.8Å; R471-T489 WeakPolarHBondContact CB-O 3.31Å; R471-M496 HydrophobicContact CB-CE 4.17Å; R471-E500 IonicContact CZ-OE2 3.87Å; R471-E500 VanDerWaalsContact CZ-OE2 3.26Å; R471-E500 IonicContact NH1-OE2 3.59Å; R471-E500 PolarHBondContact NH1-OE2 2.92Å; R471-E500 IonicContact NH2-OE2 3.72Å; R471-E500 PolarHBondContact NH2-OE2 2.96Å
472	I	89	Confident	90.9	Very high	58 Å²	58	47 Å²	47	30%	0.297	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-112.1	168	176.3	63.2	169.4	0	0	0	110.3	Q447 G474 G488 T489	Q447-I472 HydrophobicContact CG-CG2 3.92Å; I472-G474 PolarHBondContact O-N 3.31Å; I472-G488 CarbonylContact O-C 3.52Å; I472-G488 WeakPolarHBondContact O-CA 3.37Å; I472-T489 PolarHBondContact N-O 3.45Å; I472-T489 PolarHBondContact O-N 2.69Å
473	Q	86.9	Confident	90.9	Very high	98 Å²	98	46.9 Å²	46.9	46%	0.458	26%	0.255	S	S	.	.	S	Bend	trans	56.2	20.1	177.8	-59.9	177	-26.4	0	0	114.3	F433 T489	F433-Q473 HydrophobicContact CB-CG 3.74Å; F433-Q473 HydrophobicContact CD1-CG 4.2Å; F433-Q473 HydrophobicContact CD2-CG 4.32Å; F433-Q473 HydrophobicContact CG-CG 3.88Å; Q473-T489 PolarHBondContact OE1-OG1 3.21Å
474	G	89.1	Confident	90.9	Very high	4 Å²	4	41.4 Å²	41.4	4%	0.041	23%	0.231	C	C	.	.			trans	-74.3	-170.6	169.7	0	0	0	0	0	111.5	N435 I472 Y485 A487	N435-G474 PolarHBondContact ND2-O 3.03Å; I472-G474 PolarHBondContact O-N 3.31Å; G474-Y485 WeakPolarHBondContact CA-OH 3.08Å; G474-Y485 PolarHBondContact N-OH 2.93Å; G474-A487 WeakPolarHBondContact CA-O 3.33Å
475	L	92.9	Very high	91	Very high	17 Å²	17	39.7 Å²	39.7	9%	0.089	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.4	-177.7	-56.5	168.3	0	0	0	108.5	Y485 I486 L525 K526 L527 L536	L475-Y485 CarbonylContact O-C 3.49Å; L475-Y485 WeakPolarHBondContact O-CA 3.16Å; L475-I486 PolarHBondContact N-O 2.95Å; L475-I486 PolarHBondContact O-N 2.98Å; L475-L525 HydrophobicContact CD1-CB 3.69Å; L475-K526 HydrophobicContact CD2-CD 4.3Å; L475-L527 HydrophobicContact CB-CB 3.66Å; L475-L527 HydrophobicContact CB-CD2 4.03Å; L475-L527 HydrophobicContact CD1-CB 4.02Å; L475-L527 HydrophobicContact CG-CB 4.32Å; L475-L536 HydrophobicContact CD1-CD2 3.89Å
476	A	94.6	Very high	91.2	Very high	16 Å²	16	36.9 Å²	36.9	13%	0.132	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.1	177.4	0	0	0	0	0	111.5	N435 V437 L446 Y484 Y485	N435-A476 HydrophobicContact CB-CB 3.56Å; V437-A476 HydrophobicContact CG1-CB 3.95Å; L446-A476 HydrophobicContact CD1-CB 4.24Å; A476-Y484 VanDerWaalsContact CA-O 3.22Å; A476-Y484 WeakPolarHBondContact CA-O 3.34Å; A476-Y485 HydrophobicContact CB-CD2 3.97Å; A476-Y485 HydrophobicContact CB-CE2 4.48Å
477	A	94.8	Very high	91.3	Very high	11 Å²	11	34 Å²	34	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	153.7	170.1	0	0	0	0	0	110.1	Y484 L527 L529 L534	A477-Y484 PolarHBondContact N-O 3.26Å; A477-Y484 PolarHBondContact O-N 3.38Å; A477-L527 HydrophobicContact CB-CD2 3.46Å; A477-L527 VanDerWaalsContact CB-CD2 3.46Å; A477-L527 HydrophobicContact CB-CG 3.88Å; A477-L529 HydrophobicContact CB-CG 4.49Å; A477-L534 HydrophobicContact CB-CD1 4.02Å
478	V	94.4	Very high	91.3	Very high	33 Å²	33	33.9 Å²	33.9	20%	0.2	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.1	173.6	171.3	0	0	0	0	109.1	V437 E438 Y439 S482 I483 L529	V437-V478 HydrophobicContact CB-CG2 4.03Å; V437-V478 HydrophobicContact CG2-CG2 3.95Å; E438-V478 WeakPolarHBondContact O-CG2 3.07Å; Y439-V478 HydrophobicContact CD2-CG1 3.59Å; Y439-V478 HydrophobicContact CE2-CG1 4.19Å; Y439-V478 HydrophobicContact CG-CG1 4.4Å; V478-S482 WeakPolarHBondContact CA-O 3.36Å; V478-I483 HydrophobicContact CG2-CG1 3.94Å; V478-L529 VanDerWaalsContact O-CD1 3.23Å; V478-L529 WeakPolarHBondContact O-CD1 3.31Å
479	Y	93.8	Very high	91.2	Very high	12 Å²	12	30.1 Å²	30.1	5%	0.047	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	126.5	179.1	178.6	-106	0	0	0	110.2	D481 S482 Y484 L529 N532 L534 D563	Y479-D481 PolarHBondContact O-N 2.82Å; Y479-S482 PolarHBondContact N-O 2.92Å; Y479-S482 PolarHBondContact O-N 3.25Å; Y479-S482 VanDerWaalsContact O-N 3.09Å; Y479-Y484 HydrophobicContact CD1-CD2 4.36Å; Y479-Y484 AromaticContact CD1-CE2 3.73Å; Y479-Y484 HydrophobicContact CD1-CE2 3.73Å; Y479-Y484 AromaticContact CD1-CZ 3.94Å; Y479-Y484 HydrophobicContact CG-CE2 4.31Å; Y479-Y484 WeakPolarHBondContact O-CE2 3.36Å; Y479-L529 HydrophobicContact CD2-CD2 4.04Å; Y479-N532 WeakPolarHBondContact CE2-O 3.41Å; Y479-L534 HydrophobicContact CD2-CB 4.25Å; Y479-L534 HydrophobicContact CG-CB 4.3Å; Y479-D563 HydrophobicContact CE1-CB 3.88Å; Y479-D563 PolarHBondContact OH-OD1 3Å; Y479-D563 VanDerWaalsContact OH-OD1 3.14Å
480	K	88.6	Confident	91.2	Very high	119 Å²	119	29.6 Å²	29.6	52%	0.517	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.4	58.7	-179	-67.4	-177	169.9	173.4	0	112.4	S482 D563	K480-S482 PolarHBondContact O-N 2.98Å; K480-S482 VanDerWaalsContact O-N 3.12Å; K480-D563 IonicContact NZ-OD1 2.8Å; K480-D563 PolarHBondContact NZ-OD1 2.86Å; K480-D563 IonicContact NZ-OD2 2.96Å; K480-D563 PolarHBondContact NZ-OD2 2.86Å
481	D	89.6	Confident	90.6	Very high	102 Å²	102	31 Å²	31	55%	0.545	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	11.3	177	-62.6	-55.5	0	0	0	116.9	Y439 Y479	Y439-D481 HydrophobicContact CE2-CB 4.39Å; Y439-D481 WeakPolarHBondContact CE2-OD1 3.4Å; Y439-D481 WeakPolarHBondContact OH-CA 3.47Å; Y439-D481 VanDerWaalsContact OH-CB 3.23Å; Y439-D481 WeakPolarHBondContact OH-CB 3.1Å; Y439-D481 VanDerWaalsContact OH-CG 3.32Å; Y439-D481 PolarHBondContact OH-OD1 2.68Å; Y479-D481 PolarHBondContact O-N 2.82Å
482	S	93.3	Very high	89.9	Confident	22 Å²	22	35.6 Å²	35.6	15%	0.154	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.1	176.7	-63	0	0	0	0	111.7	V478 Y479 K480 Y502	V478-S482 WeakPolarHBondContact CA-O 3.36Å; Y479-S482 PolarHBondContact N-O 2.92Å; Y479-S482 PolarHBondContact O-N 3.25Å; Y479-S482 VanDerWaalsContact O-N 3.09Å; K480-S482 PolarHBondContact O-N 2.98Å; K480-S482 VanDerWaalsContact O-N 3.12Å; S482-Y502 WeakPolarHBondContact CA-O 3.44Å; S482-Y502 WeakPolarHBondContact CB-O 3.42Å
483	I	95.3	Very high	89.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	113.6	171.8	-65.7	164.6	0	0	0	108.3	V437 Y444 L446 F451 V478 A501 Y502 I504	V437-I483 HydrophobicContact CG2-CD1 4.07Å; V437-I483 HydrophobicContact CG2-CG1 4.07Å; V437-I483 HydrophobicContact CG2-CG2 4.18Å; Y444-I483 HydrophobicContact CD1-CD1 3.85Å; Y444-I483 HydrophobicContact CD2-CD1 3.92Å; Y444-I483 HydrophobicContact CE1-CD1 4.45Å; Y444-I483 HydrophobicContact CG-CD1 3.55Å; L446-I483 HydrophobicContact CD1-CG2 4.37Å; F451-I483 HydrophobicContact CZ-CD1 4.04Å; V478-I483 HydrophobicContact CG2-CG1 3.94Å; I483-A501 CarbonylContact O-C 3.57Å; I483-A501 WeakPolarHBondContact O-CA 3.34Å; I483-Y502 HydrophobicContact CD1-CD1 4.4Å; I483-Y502 PolarHBondContact N-O 3.08Å; I483-Y502 PolarHBondContact O-N 3.11Å; I483-I504 HydrophobicContact CD1-CD1 3.71Å; I483-I504 HydrophobicContact CD1-CG1 4.16Å; I483-I504 HydrophobicContact CG1-CD1 3.97Å
484	Y	95.1	Very high	89.2	Confident	12 Å²	12	40.5 Å²	40.5	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	131	173.5	-77.4	-109	0	0	0	109.5	A476 A477 Y479 V499 E500 A501 K512 L534 Y561	A476-Y484 VanDerWaalsContact CA-O 3.22Å; A476-Y484 WeakPolarHBondContact CA-O 3.34Å; A477-Y484 PolarHBondContact N-O 3.26Å; A477-Y484 PolarHBondContact O-N 3.38Å; Y479-Y484 HydrophobicContact CD1-CD2 4.36Å; Y479-Y484 AromaticContact CD1-CE2 3.73Å; Y479-Y484 HydrophobicContact CD1-CE2 3.73Å; Y479-Y484 AromaticContact CD1-CZ 3.94Å; Y479-Y484 HydrophobicContact CG-CE2 4.31Å; Y479-Y484 WeakPolarHBondContact O-CE2 3.36Å; Y484-V499 HydrophobicContact CD1-CG1 4.06Å; Y484-E500 CarbonylContact C-O 3.49Å; Y484-E500 WeakPolarHBondContact CA-O 3.42Å; Y484-A501 HydrophobicContact CD1-CB 4.07Å; Y484-A501 HydrophobicContact CD2-CB 4.25Å; Y484-A501 HydrophobicContact CE1-CB 3.83Å; Y484-A501 HydrophobicContact CE2-CB 4.01Å; Y484-A501 HydrophobicContact CG-CB 4.27Å; Y484-K512 HydrophobicContact CE1-CG 4.12Å; Y484-L534 HydrophobicContact CD1-CD2 4.01Å; Y484-L534 HydrophobicContact CG-CD2 4.18Å; Y484-Y561 AromaticContact CE1-CE1 3.86Å; Y484-Y561 HydrophobicContact CE1-CE1 3.86Å
485	Y	94.3	Very high	88.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	111	172.4	-162.7	-73.2	0	0	0	110	L446 M467 R471 G474 L475 A476 A487 E500	L446-Y485 HydrophobicContact CB-CD2 4.05Å; L446-Y485 HydrophobicContact CB-CE2 3.78Å; L446-Y485 HydrophobicContact CD2-CD2 4.01Å; L446-Y485 HydrophobicContact CG-CD2 4.45Å; M467-Y485 HydrophobicContact CE-CE2 4.41Å; M467-Y485 HydrophobicContact SD-CD1 3.71Å; M467-Y485 HydrophobicContact SD-CD2 3.84Å; M467-Y485 HydrophobicContact SD-CE1 3.86Å; M467-Y485 HydrophobicContact SD-CE2 3.98Å; M467-Y485 HydrophobicContact SD-CG 3.66Å; R471-Y485 HydrophobicContact CG-CD1 4.39Å; R471-Y485 HydrophobicContact CG-CE1 3.63Å; R471-Y485 VanDerWaalsContact CZ-CD1 3.44Å; R471-Y485 VanDerWaalsContact NE-CD1 3.3Å; R471-Y485 VanDerWaalsContact NE-CE1 3.34Å; R471-Y485 VanDerWaalsContact NH2-CD1 3.3Å; R471-Y485 PolarHBondContact NH2-O 3.36Å; R471-Y485 PolarHBondContact O-OH 2.96Å; G474-Y485 WeakPolarHBondContact CA-OH 3.08Å; G474-Y485 PolarHBondContact N-OH 2.93Å; L475-Y485 CarbonylContact O-C 3.49Å; L475-Y485 WeakPolarHBondContact O-CA 3.16Å; A476-Y485 HydrophobicContact CB-CD2 3.97Å; A476-Y485 HydrophobicContact CB-CE2 4.48Å; Y485-A487 WeakPolarHBondContact CE1-O 3.33Å; Y485-E500 PolarHBondContact N-O 2.78Å; Y485-E500 PolarHBondContact O-N 2.87Å; Y485-E500 VanDerWaalsContact O-N 3.1Å
486	I	93.3	Very high	88.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	135.4	-171.2	-65.2	166.9	0	0	0	110.5	L475 V499 L527 L534 L536 W568	L475-I486 PolarHBondContact N-O 2.95Å; L475-I486 PolarHBondContact O-N 2.98Å; I486-V499 HydrophobicContact CD1-CG1 4.4Å; I486-V499 HydrophobicContact CG1-CB 4.33Å; I486-V499 HydrophobicContact CG1-CG1 3.77Å; I486-V499 HydrophobicContact CG1-CG2 3.98Å; I486-V499 HydrophobicContact CG2-CG2 4.22Å; I486-L527 HydrophobicContact CD1-CD1 3.6Å; I486-L527 HydrophobicContact CD1-CD2 3.94Å; I486-L527 HydrophobicContact CD1-CG 4.41Å; I486-L534 HydrophobicContact CD1-CD2 3.81Å; I486-L536 HydrophobicContact CG2-CD1 4.07Å; I486-L536 HydrophobicContact CG2-CD2 4.14Å; I486-W568 HydrophobicContact CD1-CH2 3.8Å; I486-W568 HydrophobicContact CD1-CZ2 3.86Å
487	A	91.1	Very high	88.4	Confident	6 Å²	6	45.4 Å²	45.4	5%	0.05	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	56.7	-172.5	174.3	0	0	0	0	0	113.7	R471 G474 Y485 M496 F497 T498 L525	R471-A487 WeakPolarHBondContact CD-O 3.34Å; R471-A487 PolarHBondContact NE-O 2.71Å; G474-A487 WeakPolarHBondContact CA-O 3.33Å; Y485-A487 WeakPolarHBondContact CE1-O 3.33Å; A487-M496 CarbonylContact C-O 3.57Å; A487-M496 WeakPolarHBondContact CA-O 3.17Å; A487-M496 VanDerWaalsContact CB-O 3.26Å; A487-M496 WeakPolarHBondContact CB-O 3.41Å; A487-F497 HydrophobicContact CB-CD1 4.26Å; A487-T498 PolarHBondContact N-O 3.12Å; A487-L525 HydrophobicContact CB-CD1 3.89Å
488	G	88.6	Confident	88.2	Confident	6 Å²	6	45.7 Å²	45.7	6%	0.062	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.4	-175.4	176.1	0	0	0	0	0	112.3	I472 R495 M496	I472-G488 CarbonylContact O-C 3.52Å; I472-G488 WeakPolarHBondContact O-CA 3.37Å; G488-R495 WeakPolarHBondContact O-CA 3.37Å; G488-M496 PolarHBondContact N-O 2.85Å; G488-M496 VanDerWaalsContact N-O 3.12Å; G488-M496 PolarHBondContact O-N 2.89Å
489	T	87.7	Confident	88.2	Confident	23 Å²	23	44.1 Å²	44.1	14%	0.141	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.2	-179.2	-53.5	0	0	0	0	109.3	R471 I472 Q473	R471-T489 WeakPolarHBondContact CA-O 2.8Å; R471-T489 WeakPolarHBondContact CB-O 3.31Å; I472-T489 PolarHBondContact N-O 3.45Å; I472-T489 PolarHBondContact O-N 2.69Å; Q473-T489 PolarHBondContact OE1-OG1 3.21Å
490	C	86.1	Confident	88.2	Confident	38 Å²	38	43.9 Å²	43.9	26%	0.257	24%	0.236	S	C	.	.			trans	-82	167.8	175.1	-166.6	0	0	0	0	111	N492 H493 Q494 M496	C490-N492 PolarHBondContact O-N 2.81Å; C490-H493 WeakPolarHBondContact O-CA 3.26Å; C490-H493 PolarHBondContact O-N 3.38Å; C490-Q494 PolarHBondContact N-O 2.51Å; C490-M496 HydrophobicContact CB-CE 3.79Å; C490-M496 HydrophobicContact CB-SD 4.2Å
491	G	74.4	Confident	88.5	Confident	72 Å²	72	38.2 Å²	38.2	74%	0.742	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.7	-175.4	0	0	0	0	0	115.4	H493	G491-H493 PolarHBondContact O-N 2.92Å
492	N	75.3	Confident	88.7	Confident	98 Å²	98	33.5 Å²	33.5	52%	0.524	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	13.5	172.6	66.2	-10.2	0	0	0	113.8	C490 Q494	C490-N492 PolarHBondContact O-N 2.81Å; N492-Q494 PolarHBondContact ND2-OE1 3.36Å; N492-Q494 PolarHBondContact O-N 3.43Å; N492-Q494 VanDerWaalsContact O-N 3.12Å; N492-Q494 WeakPolarHBondContact OD1-CB 3.27Å; N492-Q494 PolarHBondContact OD1-N 3.21Å
493	H	77.5	Confident	88.7	Confident	166 Å²	166	34.6 Å²	34.6	77%	0.769	19%	0.191	S	C	*	.	S	Bend	trans	60	14	-173.2	-59.4	72.9	0	0	0	114.3	C490 G491	C490-H493 WeakPolarHBondContact O-CA 3.26Å; C490-H493 PolarHBondContact O-N 3.38Å; G491-H493 PolarHBondContact O-N 2.92Å
494	Q	83.3	Confident	88.3	Confident	94 Å²	94	36.3 Å²	36.3	44%	0.439	20%	0.2	S	C	.	.			trans	-80.1	127.9	175	-168.8	176.8	-0.3	0	0	109.5	C490 N492	C490-Q494 PolarHBondContact N-O 2.51Å; N492-Q494 PolarHBondContact ND2-OE1 3.36Å; N492-Q494 PolarHBondContact O-N 3.43Å; N492-Q494 VanDerWaalsContact O-N 3.12Å; N492-Q494 WeakPolarHBondContact OD1-CB 3.27Å; N492-Q494 PolarHBondContact OD1-N 3.21Å
495	R	83.6	Confident	88	Confident	86 Å²	86	43 Å²	43	33%	0.325	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	138.1	169.6	-81.9	-161.9	-62.4	-117.2	-9.3	111.2	G488 N522	G488-R495 WeakPolarHBondContact O-CA 3.37Å; R495-N522 VanDerWaalsContact CZ-CG 3.43Å; R495-N522 PolarHBondContact NH1-ND2 2.95Å; R495-N522 PolarHBondContact NH1-OD1 3.14Å; R495-N522 VanDerWaalsContact NH2-CA 3.31Å; R495-N522 VanDerWaalsContact NH2-CB 3.31Å; R495-N522 PolarHBondContact NH2-ND2 2.78Å; R495-N522 PolarHBondContact NH2-OD1 2.91Å; R495-N522 VanDerWaalsContact NH2-OD1 3.16Å
496	M	86.5	Confident	87.7	Confident	35 Å²	35	48.9 Å²	48.9	17%	0.172	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	150.5	173.4	-60.3	-173.1	-58	0	0	109.3	V469 R471 A487 G488 C490 T498	V469-M496 HydrophobicContact CB-CE 4.25Å; V469-M496 HydrophobicContact CG1-CE 3.34Å; V469-M496 HydrophobicContact CG1-SD 3.92Å; R471-M496 HydrophobicContact CB-CE 4.17Å; A487-M496 CarbonylContact C-O 3.57Å; A487-M496 WeakPolarHBondContact CA-O 3.17Å; A487-M496 VanDerWaalsContact CB-O 3.26Å; A487-M496 WeakPolarHBondContact CB-O 3.41Å; G488-M496 PolarHBondContact N-O 2.85Å; G488-M496 VanDerWaalsContact N-O 3.12Å; G488-M496 PolarHBondContact O-N 2.89Å; C490-M496 HydrophobicContact CB-CE 3.79Å; C490-M496 HydrophobicContact CB-SD 4.2Å; M496-T498 HydrophobicContact CB-CG2 4.39Å
497	F	90	Very high	87.5	Confident	18 Å²	18	52.3 Å²	52.3	8%	0.079	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	22	175.9	-60	-67	0	0	0	111.1	A487 F515 C517 P523 L525	A487-F497 HydrophobicContact CB-CD1 4.26Å; F497-F515 HydrophobicContact CB-CB 4.21Å; F497-F515 HydrophobicContact CD1-CD1 4.25Å; F497-F515 PolarHBondContact O-N 3.12Å; F497-C517 HydrophobicContact CD1-CB 4.39Å; F497-C517 HydrophobicContact CD2-CB 4.05Å; F497-C517 HydrophobicContact CE1-CB 4.34Å; F497-C517 HydrophobicContact CE2-CB 4Å; F497-C517 HydrophobicContact CG-CB 4.24Å; F497-C517 HydrophobicContact CZ-CB 4.14Å; F497-P523 HydrophobicContact CE1-CG 3.83Å; F497-P523 HydrophobicContact CZ-CG 3.82Å; F497-L525 HydrophobicContact CD1-CD1 3.64Å; F497-L525 HydrophobicContact CE1-CD1 3.68Å
498	T	91.2	Very high	87.6	Confident	18 Å²	18	58.4 Å²	58.4	11%	0.11	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	144.1	-179.5	52	0	0	0	0	111	A487 M496 D514	A487-T498 PolarHBondContact N-O 3.12Å; M496-T498 HydrophobicContact CB-CG2 4.39Å; T498-D514 VanDerWaalsContact CA-OD1 3.31Å; T498-D514 WeakPolarHBondContact CA-OD1 3.49Å
499	V	93.8	Very high	87.9	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.4	176.4	-176	0	0	0	0	108.9	Y484 I486 K512 K513 D514 W568	Y484-V499 HydrophobicContact CD1-CG1 4.06Å; I486-V499 HydrophobicContact CD1-CG1 4.4Å; I486-V499 HydrophobicContact CG1-CB 4.33Å; I486-V499 HydrophobicContact CG1-CG1 3.77Å; I486-V499 HydrophobicContact CG1-CG2 3.98Å; I486-V499 HydrophobicContact CG2-CG2 4.22Å; V499-K512 HydrophobicContact CB-CB 4.04Å; V499-K512 HydrophobicContact CG1-CB 3.78Å; V499-K512 HydrophobicContact CG1-CG 4.39Å; V499-K512 PolarHBondContact O-N 2.92Å; V499-K513 VanDerWaalsContact CG2-O 3.27Å; V499-K513 WeakPolarHBondContact CG2-O 3.24Å; V499-D514 PolarHBondContact N-OD1 3.04Å; V499-W568 HydrophobicContact CG2-CZ2 4.21Å
500	E	94.2	Very high	88.2	Confident	6 Å²	6	60.8 Å²	60.8	3%	0.028	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.7	172.7	-59.7	-178	119.9	0	0	109.7	T468 R471 Y484 Y485 W509 T510	T468-E500 WeakPolarHBondContact CB-OE1 3Å; T468-E500 PolarHBondContact OG1-OE1 2.77Å; R471-E500 IonicContact CZ-OE2 3.87Å; R471-E500 VanDerWaalsContact CZ-OE2 3.26Å; R471-E500 IonicContact NH1-OE2 3.59Å; R471-E500 PolarHBondContact NH1-OE2 2.92Å; R471-E500 IonicContact NH2-OE2 3.72Å; R471-E500 PolarHBondContact NH2-OE2 2.96Å; Y484-E500 CarbonylContact C-O 3.49Å; Y484-E500 WeakPolarHBondContact CA-O 3.42Å; Y485-E500 PolarHBondContact N-O 2.78Å; Y485-E500 PolarHBondContact O-N 2.87Å; Y485-E500 VanDerWaalsContact O-N 3.1Å; E500-W509 HydrophobicContact CB-CE3 3.62Å; E500-W509 HydrophobicContact CB-CZ3 3.96Å; E500-T510 CarbonylContact C-O 3.56Å; E500-T510 WeakPolarHBondContact CA-O 3.49Å
501	A	94.7	Very high	88.6	Confident	1 Å²	1	67 Å²	67	1%	0.008	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.2	173.9	0	0	0	0	0	109	I483 Y484 T510 K512	I483-A501 CarbonylContact O-C 3.57Å; I483-A501 WeakPolarHBondContact O-CA 3.34Å; Y484-A501 HydrophobicContact CD1-CB 4.07Å; Y484-A501 HydrophobicContact CD2-CB 4.25Å; Y484-A501 HydrophobicContact CE1-CB 3.83Å; Y484-A501 HydrophobicContact CE2-CB 4.01Å; Y484-A501 HydrophobicContact CG-CB 4.27Å; A501-T510 PolarHBondContact N-O 3.25Å; A501-T510 PolarHBondContact O-N 3.03Å; A501-T510 PolarHBondContact O-OG1 2.9Å; A501-K512 HydrophobicContact CB-CG 4.03Å
502	Y	94.7	Very high	89.5	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.1	176.1	179.7	-105.4	0	0	0	110.1	F451 L464 S482 I483 I504 N507 W509	F451-Y502 HydrophobicContact CD1-CE2 4.42Å; F451-Y502 AromaticContact CE1-CD1 3.57Å; F451-Y502 HydrophobicContact CE1-CD1 3.57Å; F451-Y502 AromaticContact CE1-CD2 3.86Å; F451-Y502 HydrophobicContact CE1-CD2 3.86Å; F451-Y502 AromaticContact CE1-CE1 3.51Å; F451-Y502 HydrophobicContact CE1-CE1 3.51Å; F451-Y502 AromaticContact CE1-CE2 3.81Å; F451-Y502 HydrophobicContact CE1-CE2 3.81Å; F451-Y502 AromaticContact CE1-CG 3.72Å; F451-Y502 HydrophobicContact CE1-CG 3.72Å; F451-Y502 AromaticContact CE1-CZ 3.64Å; F451-Y502 AromaticContact CZ-CD1 3.8Å; F451-Y502 HydrophobicContact CZ-CD1 3.8Å; F451-Y502 AromaticContact CZ-CE1 3.84Å; F451-Y502 HydrophobicContact CZ-CE1 3.84Å; F451-Y502 HydrophobicContact CZ-CG 4.29Å; L464-Y502 HydrophobicContact CD1-CE1 4.25Å; S482-Y502 WeakPolarHBondContact CA-O 3.44Å; S482-Y502 WeakPolarHBondContact CB-O 3.42Å; I483-Y502 HydrophobicContact CD1-CD1 4.4Å; I483-Y502 PolarHBondContact N-O 3.08Å; I483-Y502 PolarHBondContact O-N 3.11Å; Y502-I504 HydrophobicContact CD1-CG1 3.61Å; Y502-I504 HydrophobicContact CE1-CB 4.19Å; Y502-I504 HydrophobicContact CE1-CG1 3.61Å; Y502-N507 WeakPolarHBondContact OH-CA 3.34Å; Y502-N507 PolarHBondContact OH-OD1 3.04Å; Y502-W509 AromaticContact CD2-CD1 3.75Å; Y502-W509 AromaticContact CD2-CD2 3.81Å; Y502-W509 HydrophobicContact CD2-CD2 3.81Å; Y502-W509 AromaticContact CD2-CE2 3.55Å; Y502-W509 AromaticContact CD2-CG 3.94Å; Y502-W509 HydrophobicContact CD2-CG 3.94Å; Y502-W509 HydrophobicContact CD2-CZ2 4.09Å; Y502-W509 AromaticContact CD2-NE1 3.48Å; Y502-W509 AromaticContact CE2-NE1 3.95Å; Y502-W509 HydrophobicContact CG-CD2 4.24Å; Y502-W509 HydrophobicContact CG-CH2 4.46Å; Y502-W509 HydrophobicContact CG-CZ2 4.12Å
503	D	92.4	Very high	90.4	Very high	46 Å²	46	67.5 Å²	67.5	25%	0.246	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118	169.3	-173.3	-42.3	0	0	0	108.4	E505 L506 N507 K508	D503-E505 PolarHBondContact OD1-N 2.81Å; D503-L506 HydrophobicContact CB-CB 4.12Å; D503-L506 HydrophobicContact CB-CD1 4.48Å; D503-L506 HydrophobicContact CB-CG 4.49Å; D503-L506 PolarHBondContact OD1-N 3.38Å; D503-L506 WeakPolarHBondContact OD2-CD1 3.47Å; D503-N507 WeakPolarHBondContact O-CA 3.24Å; D503-N507 PolarHBondContact O-N 3.4Å; D503-K508 PolarHBondContact N-O 2.91Å; D503-K508 PolarHBondContact O-N 3.06Å; D503-K508 VanDerWaalsContact O-N 3.13Å
504	I	87.5	Confident	91.1	Very high	36 Å²	36	62.1 Å²	62.1	19%	0.185	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-34	-175.2	-65.2	166.2	0	0	0	111.2	Y439 Y444 I483 Y502	Y439-I504 HydrophobicContact CD1-CD1 3.07Å; Y439-I504 HydrophobicContact CD1-CG1 4.41Å; Y439-I504 HydrophobicContact CE1-CB 4.4Å; Y439-I504 HydrophobicContact CE1-CD1 3.41Å; Y439-I504 VanDerWaalsContact CE1-CD1 3.41Å; Y439-I504 HydrophobicContact CE1-CG1 4.47Å; Y439-I504 HydrophobicContact CG-CD1 3.78Å; Y444-I504 HydrophobicContact CE1-CD1 4.45Å; Y444-I504 HydrophobicContact CE2-CD1 4.29Å; I483-I504 HydrophobicContact CD1-CD1 3.71Å; I483-I504 HydrophobicContact CD1-CG1 4.16Å; I483-I504 HydrophobicContact CG1-CD1 3.97Å; Y502-I504 HydrophobicContact CD1-CG1 3.61Å; Y502-I504 HydrophobicContact CE1-CB 4.19Å; Y502-I504 HydrophobicContact CE1-CG1 3.61Å
505	E	87.9	Confident	91.4	Very high	152 Å²	152	58 Å²	58	71%	0.71	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-37.2	-179.3	-60.3	-170.5	169.3	0	0	110.6	K440 D503	K440-E505 IonicContact NZ-OE1 3.46Å; K440-E505 PolarHBondContact NZ-OE1 2.9Å; D503-E505 PolarHBondContact OD1-N 2.81Å
506	L	88.9	Confident	91.4	Very high	123 Å²	123	57.8 Å²	57.8	64%	0.644	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.7	176.9	-60	-179.7	0	0	0	114	D503 K508	D503-L506 HydrophobicContact CB-CB 4.12Å; D503-L506 HydrophobicContact CB-CD1 4.48Å; D503-L506 HydrophobicContact CB-CG 4.49Å; D503-L506 PolarHBondContact OD1-N 3.38Å; D503-L506 WeakPolarHBondContact OD2-CD1 3.47Å; L506-K508 VanDerWaalsContact C-N 3.27Å; L506-K508 HydrophobicContact CB-CB 4.27Å; L506-K508 PolarHBondContact O-N 2.92Å
507	N	88.6	Confident	91	Very high	73 Å²	73	57.5 Å²	57.5	39%	0.39	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	48.3	-173	-178.1	16.3	0	0	0	112	T465 Y502 D503	T465-N507 WeakPolarHBondContact CB-OD1 3.21Å; T465-N507 PolarHBondContact N-OD1 3.1Å; T465-N507 VanDerWaalsContact OG1-CG 3.29Å; T465-N507 PolarHBondContact OG1-ND2 3.32Å; T465-N507 PolarHBondContact OG1-O 3.44Å; T465-N507 PolarHBondContact OG1-OD1 3.05Å; Y502-N507 WeakPolarHBondContact OH-CA 3.34Å; Y502-N507 PolarHBondContact OH-OD1 3.04Å; D503-N507 WeakPolarHBondContact O-CA 3.24Å; D503-N507 PolarHBondContact O-N 3.4Å
508	K	93.1	Very high	90.1	Very high	133 Å²	133	61.1 Å²	61.1	58%	0.578	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.9	137	-171.2	-170.6	178.4	178.4	-177.1	0	112.7	D503 L506	D503-K508 PolarHBondContact N-O 2.91Å; D503-K508 PolarHBondContact O-N 3.06Å; D503-K508 VanDerWaalsContact O-N 3.13Å; L506-K508 VanDerWaalsContact C-N 3.27Å; L506-K508 HydrophobicContact CB-CB 4.27Å; L506-K508 PolarHBondContact O-N 2.92Å
509	W	94.4	Very high	88.9	Confident	20 Å²	20	67 Å²	67	8%	0.076	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	138.5	171	-68.5	95.1	0	0	0	111.8	L446 F451 T465 P466 M467 E500 Y502	L446-W509 HydrophobicContact CD2-CH2 3.63Å; L446-W509 HydrophobicContact CD2-CZ2 3.78Å; F451-W509 AromaticContact CD1-CZ2 3.66Å; F451-W509 HydrophobicContact CD1-CZ2 3.66Å; F451-W509 HydrophobicContact CE1-CH2 4.43Å; F451-W509 AromaticContact CE1-CZ2 3.58Å; F451-W509 HydrophobicContact CE1-CZ2 3.58Å; F451-W509 HydrophobicContact CZ-CZ2 4.36Å; T465-W509 PolarHBondContact O-NE1 2.82Å; P466-W509 PolarHBondContact O-NE1 2.78Å; M467-W509 HydrophobicContact CB-CZ2 4.43Å; M467-W509 HydrophobicContact CG-CD2 4.36Å; M467-W509 HydrophobicContact CG-CH2 3.63Å; M467-W509 HydrophobicContact CG-CZ2 3.4Å; M467-W509 VanDerWaalsContact CG-CZ2 3.4Å; M467-W509 HydrophobicContact CG-CZ3 4.21Å; M467-W509 HydrophobicContact SD-CH2 4.35Å; E500-W509 HydrophobicContact CB-CE3 3.62Å; E500-W509 HydrophobicContact CB-CZ3 3.96Å; Y502-W509 AromaticContact CD2-CD1 3.75Å; Y502-W509 AromaticContact CD2-CD2 3.81Å; Y502-W509 HydrophobicContact CD2-CD2 3.81Å; Y502-W509 AromaticContact CD2-CE2 3.55Å; Y502-W509 AromaticContact CD2-CG 3.94Å; Y502-W509 HydrophobicContact CD2-CG 3.94Å; Y502-W509 HydrophobicContact CD2-CZ2 4.09Å; Y502-W509 AromaticContact CD2-NE1 3.48Å; Y502-W509 AromaticContact CE2-NE1 3.95Å; Y502-W509 HydrophobicContact CG-CD2 4.24Å; Y502-W509 HydrophobicContact CG-CH2 4.46Å; Y502-W509 HydrophobicContact CG-CZ2 4.12Å
510	T	94.1	Very high	87.3	Confident	59 Å²	59	71.5 Å²	71.5	36%	0.362	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.9	174.3	61.4	0	0	0	0	109.8	E500 A501	E500-T510 CarbonylContact C-O 3.56Å; E500-T510 WeakPolarHBondContact CA-O 3.49Å; A501-T510 PolarHBondContact N-O 3.25Å; A501-T510 PolarHBondContact O-N 3.03Å; A501-T510 PolarHBondContact O-OG1 2.9Å
511	R	93.7	Very high	86.1	Confident	169 Å²	169	74.3 Å²	74.3	64%	0.638	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	134.9	176.9	-171.1	170.4	-176.7	170.1	-1.3	110	D514	R511-D514 IonicContact CZ-OD2 3.66Å; R511-D514 IonicContact NE-OD1 3.93Å; R511-D514 IonicContact NE-OD2 2.72Å; R511-D514 IonicContact NH2-OD1 3.64Å; R511-D514 IonicContact NH2-OD2 2.86Å; R511-D514 PolarHBondContact NH2-OD2 3.32Å
512	K	94.4	Very high	85.1	Confident	63 Å²	63	78 Å²	78	27%	0.274	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	178.5	175.8	-62.8	-63.7	-170.3	170.4	0	110.4	Y484 V499 A501 D514	Y484-K512 HydrophobicContact CE1-CG 4.12Å; V499-K512 HydrophobicContact CB-CB 4.04Å; V499-K512 HydrophobicContact CG1-CB 3.78Å; V499-K512 HydrophobicContact CG1-CG 4.39Å; V499-K512 PolarHBondContact O-N 2.92Å; A501-K512 HydrophobicContact CB-CG 4.03Å; K512-D514 PolarHBondContact O-N 3.32Å
513	K	92.9	Very high	84.5	Confident	118 Å²	118	78.1 Å²	78.1	51%	0.513	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-62.1	119.9	176.7	-172.1	69.3	173.8	-175.3	0	111.9	V499 D566 W568	V499-K513 VanDerWaalsContact CG2-O 3.27Å; V499-K513 WeakPolarHBondContact CG2-O 3.24Å; K513-D566 WeakPolarHBondContact CB-O 3.14Å; K513-D566 VanDerWaalsContact CB-OD1 3.24Å; K513-D566 WeakPolarHBondContact CB-OD1 3.39Å; K513-D566 VanDerWaalsContact CG-O 3.28Å; K513-D566 WeakPolarHBondContact CG-O 3.35Å; K513-D566 PolarHBondContact N-OD1 2.97Å; K513-D566 PolarHBondContact N-OD2 3.33Å; K513-W568 PolarHBondContact O-NE1 2.95Å; K513-W568 VanDerWaalsContact O-NE1 3.14Å
514	D	92.3	Very high	84.2	Confident	52 Å²	52	79 Å²	79	28%	0.278	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-58.6	145.4	175.3	-62.2	-15	0	0	0	111	T498 V499 R511 K512	T498-D514 VanDerWaalsContact CA-OD1 3.31Å; T498-D514 WeakPolarHBondContact CA-OD1 3.49Å; V499-D514 PolarHBondContact N-OD1 3.04Å; R511-D514 IonicContact CZ-OD2 3.66Å; R511-D514 IonicContact NE-OD1 3.93Å; R511-D514 IonicContact NE-OD2 2.72Å; R511-D514 IonicContact NH2-OD1 3.64Å; R511-D514 IonicContact NH2-OD2 2.86Å; R511-D514 PolarHBondContact NH2-OD2 3.32Å; K512-D514 PolarHBondContact O-N 3.32Å
515	F	89.8	Confident	84.3	Confident	8 Å²	8	78.3 Å²	78.3	4%	0.035	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-68.1	128.3	179.6	173.8	-107.5	0	0	0	110.4	F497 C517 L525 L536 V538 Y559 W568	F497-F515 HydrophobicContact CB-CB 4.21Å; F497-F515 HydrophobicContact CD1-CD1 4.25Å; F497-F515 PolarHBondContact O-N 3.12Å; F515-C517 VanDerWaalsContact C-N 3.33Å; F515-C517 HydrophobicContact CD1-CB 3.7Å; F515-C517 HydrophobicContact CE1-CB 3.59Å; F515-C517 PolarHBondContact O-N 2.85Å; F515-L525 HydrophobicContact CD1-CD1 4.41Å; F515-L525 HydrophobicContact CE1-CD2 4.01Å; F515-L536 HydrophobicContact CB-CD1 4.17Å; F515-L536 HydrophobicContact CD2-CD1 3.45Å; F515-L536 VanDerWaalsContact CD2-CD1 3.45Å; F515-L536 HydrophobicContact CE2-CD1 4Å; F515-L536 HydrophobicContact CG-CD1 3.8Å; F515-V538 HydrophobicContact CE1-CG2 4.21Å; F515-V538 HydrophobicContact CE2-CG2 4.31Å; F515-V538 HydrophobicContact CZ-CG2 3.61Å; F515-Y559 AromaticContact CE2-CD1 3.87Å; F515-Y559 HydrophobicContact CE2-CD1 3.87Å; F515-Y559 AromaticContact CE2-CD2 3.83Å; F515-Y559 HydrophobicContact CE2-CD2 3.83Å; F515-Y559 HydrophobicContact CE2-CE1 4.29Å; F515-Y559 HydrophobicContact CE2-CE2 4.25Å; F515-Y559 AromaticContact CE2-CG 3.62Å; F515-Y559 HydrophobicContact CE2-CG 3.62Å; F515-Y559 HydrophobicContact CZ-CD1 4.43Å; F515-Y559 AromaticContact CZ-CD2 3.89Å; F515-Y559 HydrophobicContact CZ-CD2 3.89Å; F515-Y559 HydrophobicContact CZ-CE1 4.47Å; F515-Y559 AromaticContact CZ-CE2 3.93Å; F515-Y559 HydrophobicContact CZ-CE2 3.93Å; F515-Y559 HydrophobicContact CZ-CG 4.15Å; F515-W568 HydrophobicContact CD2-CB 4.45Å; F515-W568 AromaticContact CD2-CD2 3.95Å; F515-W568 HydrophobicContact CD2-CD2 3.95Å; F515-W568 HydrophobicContact CD2-CE3 4.28Å; F515-W568 HydrophobicContact CD2-CG 4.02Å
516	P	84.1	Confident	84.5	Confident	82 Å²	82	72.6 Å²	72.6	53%	0.532	36%	0.363	S	S	.	.			trans	-76.3	81.5	-174.8	31.5	-36.7	0	0	0	111	W568	P516-W568 HydrophobicContact CG-CB 4.06Å
517	C	78.6	Confident	84.7	Confident	29 Å²	29	68 Å²	68	20%	0.196	34%	0.339	C	S	.	.			trans	-123.4	135.1	172.2	-161.7	0	0	0	0	111.4	F497 F515 Q519 P523	F497-C517 HydrophobicContact CD1-CB 4.39Å; F497-C517 HydrophobicContact CD2-CB 4.05Å; F497-C517 HydrophobicContact CE1-CB 4.34Å; F497-C517 HydrophobicContact CE2-CB 4Å; F497-C517 HydrophobicContact CG-CB 4.24Å; F497-C517 HydrophobicContact CZ-CB 4.14Å; F515-C517 VanDerWaalsContact C-N 3.33Å; F515-C517 HydrophobicContact CD1-CB 3.7Å; F515-C517 HydrophobicContact CE1-CB 3.59Å; F515-C517 PolarHBondContact O-N 2.85Å; C517-Q519 PolarHBondContact O-N 3.46Å; C517-P523 VanDerWaalsContact SG-CG 3.59Å
518	D	70.3	Confident	84.8	Confident	94 Å²	94	64.9 Å²	64.9	50%	0.503	32%	0.323	S	S	.	.			trans	-66.2	128.2	169.2	-176.7	1.5	0	0	0	109.6	S520 I521	D518-S520 PolarHBondContact O-N 2.96Å; D518-S520 PolarHBondContact OD1-N 3.19Å; D518-S520 PolarHBondContact OD1-OG 2.94Å; D518-S520 PolarHBondContact OD2-OG 3.09Å; D518-I521 HydrophobicContact CB-CD1 4.12Å; D518-I521 HydrophobicContact CB-CG1 4.17Å; D518-I521 PolarHBondContact O-N 3.05Å
519	Q	65.9	Low	84.8	Confident	142 Å²	142	61.9 Å²	61.9	66%	0.664	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.8	178.8	-63.3	-178.9	4.3	0	0	112.7	C517 I521	C517-Q519 PolarHBondContact O-N 3.46Å; Q519-I521 VanDerWaalsContact C-N 3.26Å; Q519-I521 PolarHBondContact O-N 2.85Å
520	S	61.5	Low	84.5	Confident	94 Å²	94	61.2 Å²	61.2	66%	0.657	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-28.8	174.8	81.9	0	0	0	0	112.2	D518	D518-S520 PolarHBondContact O-N 2.96Å; D518-S520 PolarHBondContact OD1-N 3.19Å; D518-S520 PolarHBondContact OD1-OG 2.94Å; D518-S520 PolarHBondContact OD2-OG 3.09Å
521	I	68.3	Low	84.2	Confident	65 Å²	65	63.5 Å²	63.5	33%	0.333	32%	0.317	S	S	.	.	S	Bend	trans	-84.7	135.3	178	-56.3	177.4	0	0	0	106.8	D518 Q519 P523 A540	D518-I521 HydrophobicContact CB-CD1 4.12Å; D518-I521 HydrophobicContact CB-CG1 4.17Å; D518-I521 PolarHBondContact O-N 3.05Å; Q519-I521 VanDerWaalsContact C-N 3.26Å; Q519-I521 PolarHBondContact O-N 2.85Å; I521-P523 WeakPolarHBondContact O-CD 3Å; I521-A540 HydrophobicContact CG2-CB 3.88Å
522	N	73.1	Confident	83.9	Confident	77 Å²	77	62.4 Å²	62.4	41%	0.412	32%	0.324	S	S	.	.			trans	-102.8	72.1	179.5	-172.7	-35.8	0	0	0	109.1	R495	R495-N522 VanDerWaalsContact CZ-CG 3.43Å; R495-N522 PolarHBondContact NH1-ND2 2.95Å; R495-N522 PolarHBondContact NH1-OD1 3.14Å; R495-N522 VanDerWaalsContact NH2-CA 3.31Å; R495-N522 VanDerWaalsContact NH2-CB 3.31Å; R495-N522 PolarHBondContact NH2-ND2 2.78Å; R495-N522 PolarHBondContact NH2-OD1 2.91Å; R495-N522 VanDerWaalsContact NH2-OD1 3.16Å
523	P	83.4	Confident	83.7	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.039	33%	0.329	C	S	.	.			trans	-77.3	152.4	-177.6	37.2	-40.7	0	0	0	110.6	F497 C517 I521 L525 V538 R539	F497-P523 HydrophobicContact CE1-CG 3.83Å; F497-P523 HydrophobicContact CZ-CG 3.82Å; C517-P523 VanDerWaalsContact SG-CG 3.59Å; I521-P523 WeakPolarHBondContact O-CD 3Å; P523-L525 HydrophobicContact CB-CD2 4.16Å; P523-L525 HydrophobicContact CG-CD2 4.26Å; P523-L525 HydrophobicContact CG-CG 4.44Å; P523-V538 HydrophobicContact CB-CG1 3.87Å; P523-R539 CarbonylContact C-O 3.56Å; P523-R539 VanDerWaalsContact CA-O 3.27Å; P523-R539 WeakPolarHBondContact CA-O 3.38Å
524	Y	85.2	Confident	83.8	Confident	65 Å²	65	58.1 Å²	58.1	26%	0.255	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.9	165.6	-65.3	-92	0	0	0	107.6	R539 R583	Y524-R539 PolarHBondContact N-O 2.92Å; Y524-R539 PolarHBondContact O-N 2.79Å; Y524-R583 HydrophobicContact CD1-CB 4.43Å; Y524-R583 WeakPolarHBondContact CD1-O 3.42Å; Y524-R583 HydrophobicContact CE1-CB 3.75Å; Y524-R583 HydrophobicContact CE1-CG 4.11Å; Y524-R583 WeakPolarHBondContact CE1-O 3.35Å; Y524-R583 HydrophobicContact CE2-CG 4.08Å; Y524-R583 WeakPolarHBondContact OH-CD 3.4Å; Y524-R583 WeakPolarHBondContact OH-CG 3.34Å
525	L	89.3	Confident	83.9	Confident	21 Å²	21	55.9 Å²	55.9	11%	0.11	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.5	-172	-58.8	179.7	0	0	0	110.3	L475 A487 F497 F515 P523 F537 V538	L475-L525 HydrophobicContact CD1-CB 3.69Å; A487-L525 HydrophobicContact CB-CD1 3.89Å; F497-L525 HydrophobicContact CD1-CD1 3.64Å; F497-L525 HydrophobicContact CE1-CD1 3.68Å; F515-L525 HydrophobicContact CD1-CD1 4.41Å; F515-L525 HydrophobicContact CE1-CD2 4.01Å; P523-L525 HydrophobicContact CB-CD2 4.16Å; P523-L525 HydrophobicContact CG-CD2 4.26Å; P523-L525 HydrophobicContact CG-CG 4.44Å; L525-F537 CarbonylContact C-O 3.5Å; L525-F537 WeakPolarHBondContact CA-O 3.36Å; L525-V538 HydrophobicContact CD2-CB 4.08Å; L525-V538 HydrophobicContact CD2-CG1 3.83Å; L525-V538 HydrophobicContact CD2-CG2 3.63Å
526	K	91.5	Very high	84	Confident	32 Å²	32	55.5 Å²	55.5	14%	0.139	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	136.6	166.9	-65.5	-60.9	173.9	-173.1	0	111	L475 L536 F537 F585 E586 C587	L475-K526 HydrophobicContact CD2-CD 4.3Å; K526-L536 CarbonylContact O-C 3.51Å; K526-L536 WeakPolarHBondContact O-CA 3.29Å; K526-F537 HydrophobicContact CB-CB 4.38Å; K526-F537 PolarHBondContact N-O 2.83Å; K526-F537 PolarHBondContact O-N 3.19Å; K526-F585 HydrophobicContact CB-CE2 4.21Å; K526-F585 WeakPolarHBondContact CE-O 3.43Å; K526-F585 HydrophobicContact CG-CD2 4.05Å; K526-F585 HydrophobicContact CG-CE2 3.48Å; K526-F585 VanDerWaalsContact CG-CE2 3.48Å; K526-F585 HydrophobicContact CG-CZ 3.89Å; K526-E586 WeakPolarHBondContact CD-OE2 3.38Å; K526-E586 WeakPolarHBondContact CE-OE2 3.39Å; K526-E586 IonicContact NZ-OE1 2.63Å; K526-E586 PolarHBondContact NZ-OE1 3.04Å; K526-E586 IonicContact NZ-OE2 3.46Å; K526-E586 PolarHBondContact NZ-OE2 3.25Å; K526-C587 HydrophobicContact CB-CB 3.88Å; K526-C587 HydrophobicContact CG-CB 4.32Å
527	L	93.2	Very high	84.3	Confident	25 Å²	25	51.6 Å²	51.6	13%	0.131	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.1	-179.5	-175.2	61.1	0	0	0	108.2	L475 A477 I486 L534 H535 L536	L475-L527 HydrophobicContact CB-CB 3.66Å; L475-L527 HydrophobicContact CB-CD2 4.03Å; L475-L527 HydrophobicContact CD1-CB 4.02Å; L475-L527 HydrophobicContact CG-CB 4.32Å; A477-L527 HydrophobicContact CB-CD2 3.46Å; A477-L527 VanDerWaalsContact CB-CD2 3.46Å; A477-L527 HydrophobicContact CB-CG 3.88Å; I486-L527 HydrophobicContact CD1-CD1 3.6Å; I486-L527 HydrophobicContact CD1-CD2 3.94Å; I486-L527 HydrophobicContact CD1-CG 4.41Å; L527-L534 HydrophobicContact CD1-CD1 3.51Å; L527-L534 HydrophobicContact CD1-CD2 4.26Å; L527-L534 HydrophobicContact CD1-CG 3.68Å; L527-L534 HydrophobicContact CD2-CD1 4.27Å; L527-L534 HydrophobicContact CG-CD1 4.02Å; L527-H535 WeakPolarHBondContact CD1-O 3.01Å; L527-L536 HydrophobicContact CB-CD2 4.21Å; L527-L536 HydrophobicContact CD1-CD2 3.82Å; L527-L536 HydrophobicContact CD1-CG 4.22Å
528	V	92.6	Very high	84.8	Confident	8 Å²	8	50.7 Å²	50.7	5%	0.048	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	146.1	178.5	-63.1	0	0	0	0	109.8	I288 H535 C587 V589	I288-V528 HydrophobicContact CD1-CG2 4.06Å; V528-H535 HydrophobicContact CG2-CB 3.87Å; V528-H535 PolarHBondContact N-O 2.89Å; V528-H535 PolarHBondContact O-N 3.41Å; V528-C587 HydrophobicContact CG1-CB 3.58Å; V528-V589 HydrophobicContact CB-CG2 3.69Å; V528-V589 HydrophobicContact CG1-CG2 4.09Å; V528-V589 HydrophobicContact CG2-CG2 4.2Å
529	L	92	Very high	85.6	Confident	71 Å²	71	46.6 Å²	46.6	37%	0.372	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.3	166.1	-70.3	165.7	0	0	0	107.1	A477 V478 Y479 L534 V589	A477-L529 HydrophobicContact CB-CG 4.49Å; V478-L529 VanDerWaalsContact O-CD1 3.23Å; V478-L529 WeakPolarHBondContact O-CD1 3.31Å; Y479-L529 HydrophobicContact CD2-CD2 4.04Å; L529-L534 HydrophobicContact CD2-CD1 3.84Å; L529-V589 WeakPolarHBondContact O-CG2 3.23Å
530	F	89.4	Confident	86.4	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128.4	179.1	175.6	-102.7	0	0	0	107.9	E286 I309 N532 K533 H535 V589	E286-F530 HydrophobicContact CB-CE2 3.93Å; E286-F530 HydrophobicContact CG-CD2 3.84Å; E286-F530 HydrophobicContact CG-CE2 3.72Å; I309-F530 HydrophobicContact CB-CE1 4.27Å; I309-F530 HydrophobicContact CB-CZ 4.17Å; I309-F530 HydrophobicContact CD1-CD1 3.71Å; I309-F530 HydrophobicContact CD1-CD2 4.09Å; I309-F530 HydrophobicContact CD1-CE1 3.56Å; I309-F530 HydrophobicContact CD1-CE2 3.95Å; I309-F530 HydrophobicContact CD1-CG 3.98Å; I309-F530 HydrophobicContact CD1-CZ 3.69Å; I309-F530 HydrophobicContact CG1-CZ 4.46Å; F530-N532 PolarHBondContact O-N 2.96Å; F530-K533 PolarHBondContact N-O 2.96Å; F530-K533 PolarHBondContact O-N 2.87Å; F530-K533 VanDerWaalsContact O-O 3.13Å; F530-H535 AromaticContact CD1-CE1 3.84Å; F530-H535 PolarHBondContact O-CE1 2.99Å; F530-V589 HydrophobicContact CD2-CG1 4.04Å
531	Q	86.1	Confident	87.1	Confident	106 Å²	106	39 Å²	39	50%	0.495	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	42.7	-175.6	-61.7	-179.8	-15.2	0	0	113.4	E286 K533	E286-Q531 WeakPolarHBondContact OE2-CG 3.39Å; E286-Q531 PolarHBondContact OE2-N 2.8Å; Q531-K533 PolarHBondContact O-N 3.48Å; Q531-K533 VanDerWaalsContact O-N 3.13Å
532	N	87.4	Confident	87.2	Confident	147 Å²	147	40 Å²	40	79%	0.786	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	26.7	-176.2	-63.8	-11.8	0	0	0	114.4	Y479 F530	Y479-N532 WeakPolarHBondContact CE2-O 3.41Å; F530-N532 PolarHBondContact O-N 2.96Å
533	K	91.7	Very high	87	Confident	90 Å²	90	40.4 Å²	40.4	39%	0.391	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.8	174.3	-65.8	-178.1	-174	177.8	0	110.7	F530 Q531 H535 Q560	F530-K533 PolarHBondContact N-O 2.96Å; F530-K533 PolarHBondContact O-N 2.87Å; F530-K533 VanDerWaalsContact O-O 3.13Å; Q531-K533 PolarHBondContact O-N 3.48Å; Q531-K533 VanDerWaalsContact O-N 3.13Å; K533-H535 PolarHBondContact O-ND1 2.78Å; K533-Q560 HydrophobicContact CB-CG 4.37Å; K533-Q560 HydrophobicContact CD-CG 4.31Å
534	L	93.8	Very high	86.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	124.3	-179.8	-164.5	71.8	0	0	0	110.2	A477 Y479 Y484 I486 L527 L529 Y561 W568	A477-L534 HydrophobicContact CB-CD1 4.02Å; Y479-L534 HydrophobicContact CD2-CB 4.25Å; Y479-L534 HydrophobicContact CG-CB 4.3Å; Y484-L534 HydrophobicContact CD1-CD2 4.01Å; Y484-L534 HydrophobicContact CG-CD2 4.18Å; I486-L534 HydrophobicContact CD1-CD2 3.81Å; L527-L534 HydrophobicContact CD1-CD1 3.51Å; L527-L534 HydrophobicContact CD1-CD2 4.26Å; L527-L534 HydrophobicContact CD1-CG 3.68Å; L527-L534 HydrophobicContact CD2-CD1 4.27Å; L527-L534 HydrophobicContact CG-CD1 4.02Å; L529-L534 HydrophobicContact CD2-CD1 3.84Å; L534-Y561 HydrophobicContact CD2-CD1 4.2Å; L534-Y561 HydrophobicContact CD2-CG 4.48Å; L534-Y561 PolarHBondContact O-N 3.06Å; L534-W568 HydrophobicContact CD2-CH2 4.19Å
535	H	94	Very high	85.5	Confident	5 Å²	5	43.7 Å²	43.7	2%	0.023	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.9	180	-67.3	82.7	0	0	0	112.2	L527 V528 F530 K533 L558 Y559	L527-H535 WeakPolarHBondContact CD1-O 3.01Å; V528-H535 HydrophobicContact CG2-CB 3.87Å; V528-H535 PolarHBondContact N-O 2.89Å; V528-H535 PolarHBondContact O-N 3.41Å; F530-H535 AromaticContact CD1-CE1 3.84Å; F530-H535 PolarHBondContact O-CE1 2.99Å; K533-H535 PolarHBondContact O-ND1 2.78Å; H535-L558 HydrophobicContact CB-CD1 3.94Å; H535-L558 HydrophobicContact CB-CG 4.35Å; H535-Y559 CarbonylContact C-O 3.54Å; H535-Y559 WeakPolarHBondContact CA-O 3.34Å
536	L	93	Very high	84.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.3	171	-77.8	171.7	0	0	0	110	L475 I486 F515 K526 L527 V538 L558 Y559 W568	L475-L536 HydrophobicContact CD1-CD2 3.89Å; I486-L536 HydrophobicContact CG2-CD1 4.07Å; I486-L536 HydrophobicContact CG2-CD2 4.14Å; F515-L536 HydrophobicContact CB-CD1 4.17Å; F515-L536 HydrophobicContact CD2-CD1 3.45Å; F515-L536 VanDerWaalsContact CD2-CD1 3.45Å; F515-L536 HydrophobicContact CE2-CD1 4Å; F515-L536 HydrophobicContact CG-CD1 3.8Å; K526-L536 CarbonylContact O-C 3.51Å; K526-L536 WeakPolarHBondContact O-CA 3.29Å; L527-L536 HydrophobicContact CB-CD2 4.21Å; L527-L536 HydrophobicContact CD1-CD2 3.82Å; L527-L536 HydrophobicContact CD1-CG 4.22Å; L536-V538 HydrophobicContact CB-CG2 4.35Å; L536-L558 WeakPolarHBondContact O-CA 3.26Å; L536-Y559 PolarHBondContact N-O 2.84Å; L536-Y559 PolarHBondContact O-N 2.86Å; L536-W568 HydrophobicContact CB-CH2 4.45Å; L536-W568 HydrophobicContact CB-CZ3 3.96Å; L536-W568 HydrophobicContact CD1-CD2 4.29Å; L536-W568 HydrophobicContact CD1-CE3 3.94Å; L536-W568 HydrophobicContact CD1-CH2 3.3Å; L536-W568 HydrophobicContact CD1-CZ2 3.69Å; L536-W568 HydrophobicContact CD1-CZ3 3.44Å; L536-W568 VanDerWaalsContact CD1-CZ3 3.44Å; L536-W568 HydrophobicContact CG-CE3 4.4Å; L536-W568 HydrophobicContact CG-CH2 3.53Å; L536-W568 HydrophobicContact CG-CZ2 4.39Å; L536-W568 HydrophobicContact CG-CZ3 3.53Å
537	F	90.9	Very high	83.4	Confident	1 Å²	1	54 Å²	54	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	121.1	167.6	-166.4	-81.4	0	0	0	109.2	I288 L307 L525 K526 N556 L558 W579 L581 F585	I288-F537 HydrophobicContact CD1-CD2 4.31Å; I288-F537 HydrophobicContact CG2-CD2 4.37Å; L307-F537 HydrophobicContact CD2-CE2 4.48Å; L525-F537 CarbonylContact C-O 3.5Å; L525-F537 WeakPolarHBondContact CA-O 3.36Å; K526-F537 HydrophobicContact CB-CB 4.38Å; K526-F537 PolarHBondContact N-O 2.83Å; K526-F537 PolarHBondContact O-N 3.19Å; F537-N556 HydrophobicContact CE1-CB 3.99Å; F537-N556 HydrophobicContact CZ-CB 3.66Å; F537-L558 HydrophobicContact CB-CD1 4.19Å; F537-L558 HydrophobicContact CD2-CD1 4.11Å; F537-W579 HydrophobicContact CE1-CH2 4.44Å; F537-W579 HydrophobicContact CE2-CH2 4.25Å; F537-W579 HydrophobicContact CE2-CZ2 4.48Å; F537-W579 AromaticContact CZ-CH2 3.61Å; F537-W579 HydrophobicContact CZ-CH2 3.61Å; F537-W579 HydrophobicContact CZ-CZ2 4Å; F537-L581 HydrophobicContact CE1-CD1 3.55Å; F537-L581 HydrophobicContact CZ-CD1 4.04Å; F537-F585 AromaticContact CD1-CE2 3.66Å; F537-F585 HydrophobicContact CD1-CE2 3.66Å; F537-F585 AromaticContact CD1-CZ 3.9Å; F537-F585 HydrophobicContact CD1-CZ 3.9Å; F537-F585 AromaticContact CE1-CE2 3.98Å; F537-F585 HydrophobicContact CE1-CE2 3.98Å; F537-F585 HydrophobicContact CE1-CZ 4.23Å
538	V	89.1	Confident	82.1	Confident	9 Å²	9	61.7 Å²	61.7	6%	0.055	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.9	-170	-176.2	0	0	0	0	108.9	F515 P523 L525 L536 N556 S557 Y559	F515-V538 HydrophobicContact CE1-CG2 4.21Å; F515-V538 HydrophobicContact CE2-CG2 4.31Å; F515-V538 HydrophobicContact CZ-CG2 3.61Å; P523-V538 HydrophobicContact CB-CG1 3.87Å; L525-V538 HydrophobicContact CD2-CB 4.08Å; L525-V538 HydrophobicContact CD2-CG1 3.83Å; L525-V538 HydrophobicContact CD2-CG2 3.63Å; L536-V538 HydrophobicContact CB-CG2 4.35Å; V538-N556 CarbonylContact O-C 3.55Å; V538-N556 WeakPolarHBondContact O-CA 3.12Å; V538-S557 PolarHBondContact N-O 2.87Å; V538-S557 PolarHBondContact O-N 3.16Å; V538-Y559 HydrophobicContact CB-CD2 4.3Å; V538-Y559 HydrophobicContact CB-CE2 4.14Å; V538-Y559 HydrophobicContact CG2-CD2 3.49Å; V538-Y559 VanDerWaalsContact CG2-CD2 3.49Å; V538-Y559 HydrophobicContact CG2-CE2 3.72Å
539	R	86	Confident	80.7	Confident	8 Å²	8	65.2 Å²	65.2	3%	0.03	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	111.5	168.9	-177.1	-172.7	86	99.3	8.6	109.4	P523 Y524 N556 L581 G582 F585	P523-R539 CarbonylContact C-O 3.56Å; P523-R539 VanDerWaalsContact CA-O 3.27Å; P523-R539 WeakPolarHBondContact CA-O 3.38Å; Y524-R539 PolarHBondContact N-O 2.92Å; Y524-R539 PolarHBondContact O-N 2.79Å; R539-N556 WeakPolarHBondContact CG-OD1 3.13Å; R539-L581 VanDerWaalsContact CD-CB 3.4Å; R539-L581 HydrophobicContact CG-CB 4.46Å; R539-L581 PolarHBondContact NH1-O 2.92Å; R539-G582 VanDerWaalsContact CZ-O 3.22Å; R539-G582 PolarHBondContact NE-O 3.13Å; R539-F585 HydrophobicContact CB-CE1 3.73Å; R539-F585 HydrophobicContact CB-CZ 3.95Å; R539-F585 HydrophobicContact CG-CE1 4.47Å
540	A	82.4	Confident	79.4	Confident	23 Å²	23	69.3 Å²	69.3	19%	0.19	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.2	177.7	0	0	0	0	0	111	I521 K555	I521-A540 HydrophobicContact CG2-CB 3.88Å; A540-K555 PolarHBondContact N-O 3.37Å; A540-K555 PolarHBondContact O-N 2.83Å
541	T	76.9	Confident	78.2	Confident	55 Å²	55	75.6 Å²	75.6	34%	0.337	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	111.2	167	-56.6	0	0	0	0	107.5	S553	T541-S553 CarbonylContact C-O 3.54Å
542	Q	70.3	Confident	77.2	Confident	86 Å²	86	75.4 Å²	75.4	40%	0.402	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	130.4	174.4	-172.4	172.9	23.7	0	0	108.5	T544 T552 S553 K555	Q542-T544 HydrophobicContact CG-CG2 4.2Å; Q542-T552 CarbonylContact O-C 3.56Å; Q542-T552 WeakPolarHBondContact O-CA 3.41Å; Q542-S553 PolarHBondContact N-O 3.42Å; Q542-S553 PolarHBondContact O-N 2.83Å; Q542-K555 VanDerWaalsContact OE1-CE 3.24Å
543	V	69.6	Low	76.3	Confident	85 Å²	85	69.9 Å²	69.9	52%	0.515	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.3	172.2	-170.9	0	0	0	0	107.1	F550 R551 T552	V543-F550 HydrophobicContact CG1-CB 4.36Å; V543-F550 HydrophobicContact CG1-CD1 3.87Å; V543-R551 CarbonylContact C-O 3.58Å; V543-R551 WeakPolarHBondContact CA-O 3.32Å; V543-T552 HydrophobicContact CG1-CG2 4.39Å; V543-T552 HydrophobicContact CG2-CG2 4.09Å
544	T	67.8	Low	75.5	Confident	45 Å²	45	71.4 Å²	71.4	28%	0.276	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141.5	171.1	56	0	0	0	0	109.3	Q542 R551	Q542-T544 HydrophobicContact CG-CG2 4.2Å; T544-R551 PolarHBondContact N-O 2.86Å; T544-R551 PolarHBondContact O-N 3.17Å
545	V	69.1	Low	74.8	Confident	94 Å²	94	73.5 Å²	73.5	57%	0.57	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	103.2	173.6	-177.1	0	0	0	0	106.9	F550	V545-F550 HydrophobicContact CG2-CD1 3.81Å; V545-F550 HydrophobicContact CG2-CE1 3.8Å
546	E	66.8	Low	74.4	Confident	93 Å²	93	73.5 Å²	73.5	44%	0.435	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.4	172.1	-73.3	176.8	179.7	0	0	107.3	H548 V549 R551	E546-H548 VanDerWaalsContact C-N 3.28Å; E546-H548 PolarHBondContact O-N 2.91Å; E546-H548 VanDerWaalsContact O-N 3.15Å; E546-V549 PolarHBondContact N-O 3.08Å; E546-V549 WeakPolarHBondContact O-CA 3.41Å; E546-V549 WeakPolarHBondContact O-CB 3.25Å; E546-V549 PolarHBondContact O-N 2.99Å; E546-R551 VanDerWaalsContact OE2-CD 3.32Å; E546-R551 WeakPolarHBondContact OE2-CD 3.28Å; E546-R551 IonicContact OE2-CZ 2.62Å; E546-R551 VanDerWaalsContact OE2-CZ 3.28Å; E546-R551 IonicContact OE2-NE 3.07Å; E546-R551 PolarHBondContact OE2-NE 3.49Å; E546-R551 IonicContact OE2-NH1 2.73Å; E546-R551 PolarHBondContact OE2-NH1 3.26Å
547	E	70.1	Confident	74.1	Confident	178 Å²	178	74 Å²	74	83%	0.832	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	39.4	173.6	-56.7	-178.1	160.5	0	0	114.7	V549	E547-V549 PolarHBondContact O-N 2.82Å
548	H	64.5	Low	74.1	Confident	185 Å²	185	74 Å²	74	86%	0.856	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	13.3	-175.7	-54.7	75.7	0	0	0	115.1	E546	E546-H548 VanDerWaalsContact C-N 3.28Å; E546-H548 PolarHBondContact O-N 2.91Å; E546-H548 VanDerWaalsContact O-N 3.15Å
549	V	63.5	Low	74.3	Confident	82 Å²	82	75.6 Å²	75.6	50%	0.497	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.7	172.5	-176.9	0	0	0	0	109.4	E546 E547 R551	E546-V549 PolarHBondContact N-O 3.08Å; E546-V549 WeakPolarHBondContact O-CA 3.41Å; E546-V549 WeakPolarHBondContact O-CB 3.25Å; E546-V549 PolarHBondContact O-N 2.99Å; E547-V549 PolarHBondContact O-N 2.82Å; V549-R551 PolarHBondContact O-N 3.41Å
550	F	64.5	Low	74.6	Confident	157 Å²	157	76.9 Å²	76.9	69%	0.689	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	109.5	171.1	-65.5	-82.8	0	0	0	109.5	V543 V545	V543-F550 HydrophobicContact CG1-CB 4.36Å; V543-F550 HydrophobicContact CG1-CD1 3.87Å; V545-F550 HydrophobicContact CG2-CD1 3.81Å; V545-F550 HydrophobicContact CG2-CE1 3.8Å
551	R	63.9	Low	75.2	Confident	139 Å²	139	75.9 Å²	75.9	53%	0.525	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.4	169.6	-70.1	-175.2	176.1	-171	-2.5	108.7	V543 T544 E546 V549	V543-R551 CarbonylContact C-O 3.58Å; V543-R551 WeakPolarHBondContact CA-O 3.32Å; T544-R551 PolarHBondContact N-O 2.86Å; T544-R551 PolarHBondContact O-N 3.17Å; E546-R551 VanDerWaalsContact OE2-CD 3.32Å; E546-R551 WeakPolarHBondContact OE2-CD 3.28Å; E546-R551 IonicContact OE2-CZ 2.62Å; E546-R551 VanDerWaalsContact OE2-CZ 3.28Å; E546-R551 IonicContact OE2-NE 3.07Å; E546-R551 PolarHBondContact OE2-NE 3.49Å; E546-R551 IonicContact OE2-NH1 2.73Å; E546-R551 PolarHBondContact OE2-NH1 3.26Å; V549-R551 PolarHBondContact O-N 3.41Å
552	T	66.1	Low	75.9	Confident	101 Å²	101	75.4 Å²	75.4	62%	0.62	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.7	173	59	0	0	0	0	108.6	Q542 V543	Q542-T552 CarbonylContact O-C 3.56Å; Q542-T552 WeakPolarHBondContact O-CA 3.41Å; V543-T552 HydrophobicContact CG1-CG2 4.39Å; V543-T552 HydrophobicContact CG2-CG2 4.09Å
553	S	69.1	Low	76.7	Confident	32 Å²	32	73.8 Å²	73.8	22%	0.224	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	139.5	170.7	63.1	0	0	0	0	109.2	T541 Q542	T541-S553 CarbonylContact C-O 3.54Å; Q542-S553 PolarHBondContact N-O 3.42Å; Q542-S553 PolarHBondContact O-N 2.83Å
554	R	74.5	Confident	77.7	Confident	122 Å²	122	77.1 Å²	77.1	46%	0.46	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.1	173.5	-65.7	176.3	-171.7	175	15.6	107.1	D580	R554-D580 WeakPolarHBondContact CD-OD1 3.27Å; R554-D580 IonicContact CZ-OD1 3.71Å; R554-D580 IonicContact CZ-OD2 2.82Å; R554-D580 IonicContact NE-OD1 3.07Å; R554-D580 IonicContact NH1-OD1 3.75Å; R554-D580 PolarHBondContact NH1-OD1 3.19Å; R554-D580 IonicContact NH1-OD2 3.48Å; R554-D580 PolarHBondContact NH1-OD2 3.46Å
555	K	79.1	Confident	78.8	Confident	44 Å²	44	77.3 Å²	77.3	19%	0.191	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.7	-179.4	-70.2	-166.4	167	-158.9	0	110.3	A540 Q542 E573 D576	A540-K555 PolarHBondContact N-O 3.37Å; A540-K555 PolarHBondContact O-N 2.83Å; Q542-K555 VanDerWaalsContact OE1-CE 3.24Å; K555-E573 WeakPolarHBondContact CD-OE1 3.49Å; K555-E573 IonicContact NZ-OE1 2.75Å; K555-E573 PolarHBondContact NZ-OE1 3.5Å; K555-D576 WeakPolarHBondContact CE-OD1 3.44Å
556	N	84.6	Confident	79.8	Confident	5 Å²	5	75.4 Å²	75.4	3%	0.027	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.6	171.5	-53	-38.7	0	0	0	108.5	F537 V538 R539 T574	F537-N556 HydrophobicContact CE1-CB 3.99Å; F537-N556 HydrophobicContact CZ-CB 3.66Å; V538-N556 CarbonylContact O-C 3.55Å; V538-N556 WeakPolarHBondContact O-CA 3.12Å; R539-N556 WeakPolarHBondContact CG-OD1 3.13Å; N556-T574 HydrophobicContact CB-CG2 3.77Å; N556-T574 WeakPolarHBondContact CB-OG1 3.35Å; N556-T574 PolarHBondContact N-OG1 3.38Å; N556-T574 PolarHBondContact O-N 3.43Å; N556-T574 PolarHBondContact O-OG1 3.01Å
557	S	87.8	Confident	81.1	Confident	10 Å²	10	76.4 Å²	76.4	7%	0.07	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	146	-179	-67.7	0	0	0	0	109.7	V538 K570 Y572	V538-S557 PolarHBondContact N-O 2.87Å; V538-S557 PolarHBondContact O-N 3.16Å; S557-K570 WeakPolarHBondContact OG-CE 3.23Å; S557-K570 PolarHBondContact OG-NZ 3.38Å; S557-Y572 CarbonylContact C-O 3.59Å; S557-Y572 WeakPolarHBondContact CA-O 3.46Å
558	L	90.4	Very high	82.2	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.5	175.2	-167.8	69.4	0	0	0	109.1	I288 I309 H535 L536 F537 V571 Y572	I288-L558 HydrophobicContact CD1-CD1 3.74Å; I288-L558 HydrophobicContact CD1-CD2 4.07Å; I309-L558 HydrophobicContact CD1-CD2 3.36Å; I309-L558 HydrophobicContact CG1-CD2 3.94Å; I309-L558 HydrophobicContact CG2-CD2 4.42Å; H535-L558 HydrophobicContact CB-CD1 3.94Å; H535-L558 HydrophobicContact CB-CG 4.35Å; L536-L558 WeakPolarHBondContact O-CA 3.26Å; F537-L558 HydrophobicContact CB-CD1 4.19Å; F537-L558 HydrophobicContact CD2-CD1 4.11Å; L558-V571 HydrophobicContact CB-CG2 4.01Å; L558-V571 HydrophobicContact CD2-CG2 3.88Å; L558-V571 HydrophobicContact CG-CG2 3.9Å; L558-V571 WeakPolarHBondContact O-CG2 3.37Å; L558-V571 PolarHBondContact O-N 2.61Å; L558-Y572 PolarHBondContact N-O 3.21Å; L558-Y572 PolarHBondContact O-N 2.86Å
559	Y	92.7	Very high	83.5	Confident	43 Å²	43	64.2 Å²	64.2	17%	0.169	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.3	174.7	-67.7	-103.4	0	0	0	109.2	F515 H535 L536 V538 M569 K570	F515-Y559 AromaticContact CE2-CD1 3.87Å; F515-Y559 HydrophobicContact CE2-CD1 3.87Å; F515-Y559 AromaticContact CE2-CD2 3.83Å; F515-Y559 HydrophobicContact CE2-CD2 3.83Å; F515-Y559 HydrophobicContact CE2-CE1 4.29Å; F515-Y559 HydrophobicContact CE2-CE2 4.25Å; F515-Y559 AromaticContact CE2-CG 3.62Å; F515-Y559 HydrophobicContact CE2-CG 3.62Å; F515-Y559 HydrophobicContact CZ-CD1 4.43Å; F515-Y559 AromaticContact CZ-CD2 3.89Å; F515-Y559 HydrophobicContact CZ-CD2 3.89Å; F515-Y559 HydrophobicContact CZ-CE1 4.47Å; F515-Y559 AromaticContact CZ-CE2 3.93Å; F515-Y559 HydrophobicContact CZ-CE2 3.93Å; F515-Y559 HydrophobicContact CZ-CG 4.15Å; H535-Y559 CarbonylContact C-O 3.54Å; H535-Y559 WeakPolarHBondContact CA-O 3.34Å; L536-Y559 PolarHBondContact N-O 2.84Å; L536-Y559 PolarHBondContact O-N 2.86Å; V538-Y559 HydrophobicContact CB-CD2 4.3Å; V538-Y559 HydrophobicContact CB-CE2 4.14Å; V538-Y559 HydrophobicContact CG2-CD2 3.49Å; V538-Y559 VanDerWaalsContact CG2-CD2 3.49Å; V538-Y559 HydrophobicContact CG2-CE2 3.72Å; Y559-M569 CarbonylContact C-O 3.56Å; Y559-M569 VanDerWaalsContact CA-O 3.23Å; Y559-M569 WeakPolarHBondContact CA-O 3.39Å; Y559-K570 HydrophobicContact CD1-CG 4.42Å; Y559-K570 HydrophobicContact CE2-CG 4.44Å; Y559-K570 HydrophobicContact CE1-CG 4.05Å; Y559-K570 HydrophobicContact CE1-CD 4.33Å; Y559-K570 HydrophobicContact CE1-CB 3.67Å; Y559-K570 HydrophobicContact CD1-CB 3.91Å
560	Q	93.4	Very high	84.8	Confident	36 Å²	36	64.7 Å²	64.7	17%	0.168	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137	172.7	-173.6	-170.2	-63.3	0	0	108.9	K533 M569 V571	K533-Q560 HydrophobicContact CB-CG 4.37Å; K533-Q560 HydrophobicContact CD-CG 4.31Å; Q560-M569 PolarHBondContact N-O 3.42Å; Q560-M569 PolarHBondContact O-N 3.23Å; Q560-V571 HydrophobicContact CB-CG1 3.58Å; Q560-V571 HydrophobicContact CB-CG2 4.28Å
561	Y	93.9	Very high	86	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	127.8	169.9	-174.4	-119.8	0	0	0	110	Y484 L534 D563 D566 W568	Y484-Y561 AromaticContact CE1-CE1 3.86Å; Y484-Y561 HydrophobicContact CE1-CE1 3.86Å; L534-Y561 HydrophobicContact CD2-CD1 4.2Å; L534-Y561 HydrophobicContact CD2-CG 4.48Å; L534-Y561 PolarHBondContact O-N 3.06Å; Y561-D563 HydrophobicContact CD1-CB 4.37Å; Y561-D563 HydrophobicContact CE1-CB 4.08Å; Y561-D566 WeakPolarHBondContact CE2-OD1 3.12Å; Y561-D566 PolarHBondContact OH-OD1 2.86Å; Y561-W568 AromaticContact CD2-CD2 3.93Å; Y561-W568 HydrophobicContact CD2-CD2 3.93Å; Y561-W568 AromaticContact CD2-CE2 3.58Å; Y561-W568 HydrophobicContact CD2-CE3 4.46Å; Y561-W568 HydrophobicContact CD2-CG 4.31Å; Y561-W568 HydrophobicContact CD2-CH2 4.37Å; Y561-W568 AromaticContact CD2-CZ2 3.83Å; Y561-W568 HydrophobicContact CD2-CZ2 3.83Å; Y561-W568 AromaticContact CD2-NE1 3.75Å; Y561-W568 HydrophobicContact CG-CH2 4.25Å; Y561-W568 HydrophobicContact CG-CZ2 4.12Å
562	D	91.8	Very high	87	Confident	44 Å²	44	55.7 Å²	55.7	24%	0.235	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.3	167.6	-174.1	-23.3	0	0	0	108.3	I564 A565 D566 Q567 M569	D562-I564 WeakPolarHBondContact OD1-CB 3.35Å; D562-I564 PolarHBondContact OD1-N 3.22Å; D562-A565 HydrophobicContact CB-CB 4.21Å; D562-A565 PolarHBondContact OD1-N 2.84Å; D562-D566 WeakPolarHBondContact O-CA 3.15Å; D562-D566 PolarHBondContact O-N 3.14Å; D562-Q567 PolarHBondContact N-O 2.77Å; D562-Q567 PolarHBondContact O-N 2.9Å; D562-Q567 VanDerWaalsContact O-N 3.08Å; D562-M569 HydrophobicContact CB-CE 3.95Å
563	D	88.4	Confident	87.8	Confident	53 Å²	53	54.5 Å²	54.5	28%	0.283	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-22.5	-177.2	70	-75.5	0	0	0	113.4	Y479 K480 Y561	Y479-D563 HydrophobicContact CE1-CB 3.88Å; Y479-D563 PolarHBondContact OH-OD1 3Å; Y479-D563 VanDerWaalsContact OH-OD1 3.14Å; K480-D563 IonicContact NZ-OD1 2.8Å; K480-D563 PolarHBondContact NZ-OD1 2.86Å; K480-D563 IonicContact NZ-OD2 2.96Å; K480-D563 PolarHBondContact NZ-OD2 2.86Å; Y561-D563 HydrophobicContact CD1-CB 4.37Å; Y561-D563 HydrophobicContact CE1-CB 4.08Å
564	I	89.4	Confident	88	Confident	155 Å²	155	53.4 Å²	53.4	80%	0.795	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-45.2	177.5	-58.3	173.8	0	0	0	109.1	D562	D562-I564 WeakPolarHBondContact OD1-CB 3.35Å; D562-I564 PolarHBondContact OD1-N 3.22Å
565	A	90.6	Very high	87.7	Confident	49 Å²	49	51.2 Å²	51.2	41%	0.405	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-13.7	178.8	0	0	0	0	0	113.8	D562 Q567	D562-A565 HydrophobicContact CB-CB 4.21Å; D562-A565 PolarHBondContact OD1-N 2.84Å; A565-Q567 HydrophobicContact CB-CB 4.35Å; A565-Q567 WeakPolarHBondContact O-CG 3.47Å; A565-Q567 HydrophobicContact CB-CG 4.4Å
566	D	91.5	Very high	86.8	Confident	54 Å²	54	53.9 Å²	53.9	29%	0.289	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	55	-168.1	-170.4	24.5	0	0	0	111.5	K513 Y561 D562	K513-D566 WeakPolarHBondContact CB-O 3.14Å; K513-D566 VanDerWaalsContact CB-OD1 3.24Å; K513-D566 WeakPolarHBondContact CB-OD1 3.39Å; K513-D566 VanDerWaalsContact CG-O 3.28Å; K513-D566 WeakPolarHBondContact CG-O 3.35Å; K513-D566 PolarHBondContact N-OD1 2.97Å; K513-D566 PolarHBondContact N-OD2 3.33Å; Y561-D566 WeakPolarHBondContact CE2-OD1 3.12Å; Y561-D566 PolarHBondContact OH-OD1 2.86Å; D562-D566 WeakPolarHBondContact O-CA 3.15Å; D562-D566 PolarHBondContact O-N 3.14Å
567	Q	92.9	Very high	85.6	Confident	113 Å²	113	65.3 Å²	65.3	53%	0.528	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.1	-176	-71.2	-177.2	18.8	0	0	112.9	D562 A565	D562-Q567 PolarHBondContact N-O 2.77Å; D562-Q567 PolarHBondContact O-N 2.9Å; D562-Q567 VanDerWaalsContact O-N 3.08Å; A565-Q567 HydrophobicContact CB-CB 4.35Å; A565-Q567 WeakPolarHBondContact O-CG 3.47Å; A565-Q567 HydrophobicContact CB-CG 4.4Å
568	W	92.8	Very high	84.1	Confident	24 Å²	24	67.5 Å²	67.5	9%	0.091	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.7	174.7	-69.1	93.2	0	0	0	110.3	I486 V499 K513 F515 P516 L534 L536 Y561	I486-W568 HydrophobicContact CD1-CH2 3.8Å; I486-W568 HydrophobicContact CD1-CZ2 3.86Å; V499-W568 HydrophobicContact CG2-CZ2 4.21Å; K513-W568 PolarHBondContact O-NE1 2.95Å; K513-W568 VanDerWaalsContact O-NE1 3.14Å; F515-W568 HydrophobicContact CD2-CB 4.45Å; F515-W568 AromaticContact CD2-CD2 3.95Å; F515-W568 HydrophobicContact CD2-CD2 3.95Å; F515-W568 HydrophobicContact CD2-CE3 4.28Å; F515-W568 HydrophobicContact CD2-CG 4.02Å; P516-W568 HydrophobicContact CG-CB 4.06Å; L534-W568 HydrophobicContact CD2-CH2 4.19Å; L536-W568 HydrophobicContact CB-CH2 4.45Å; L536-W568 HydrophobicContact CB-CZ3 3.96Å; L536-W568 HydrophobicContact CD1-CD2 4.29Å; L536-W568 HydrophobicContact CD1-CE3 3.94Å; L536-W568 HydrophobicContact CD1-CH2 3.3Å; L536-W568 HydrophobicContact CD1-CZ2 3.69Å; L536-W568 HydrophobicContact CD1-CZ3 3.44Å; L536-W568 VanDerWaalsContact CD1-CZ3 3.44Å; L536-W568 HydrophobicContact CG-CE3 4.4Å; L536-W568 HydrophobicContact CG-CH2 3.53Å; L536-W568 HydrophobicContact CG-CZ2 4.39Å; L536-W568 HydrophobicContact CG-CZ3 3.53Å; Y561-W568 AromaticContact CD2-CD2 3.93Å; Y561-W568 HydrophobicContact CD2-CD2 3.93Å; Y561-W568 AromaticContact CD2-CE2 3.58Å; Y561-W568 HydrophobicContact CD2-CE3 4.46Å; Y561-W568 HydrophobicContact CD2-CG 4.31Å; Y561-W568 HydrophobicContact CD2-CH2 4.37Å; Y561-W568 AromaticContact CD2-CZ2 3.83Å; Y561-W568 HydrophobicContact CD2-CZ2 3.83Å; Y561-W568 AromaticContact CD2-NE1 3.75Å; Y561-W568 HydrophobicContact CG-CH2 4.25Å; Y561-W568 HydrophobicContact CG-CZ2 4.12Å
569	M	92.2	Very high	83	Confident	84 Å²	84	69.3 Å²	69.3	41%	0.414	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.4	176.9	-68.1	-173.8	-67.5	0	0	110.6	Y559 Q560 D562 V571	Y559-M569 CarbonylContact C-O 3.56Å; Y559-M569 VanDerWaalsContact CA-O 3.23Å; Y559-M569 WeakPolarHBondContact CA-O 3.39Å; Q560-M569 PolarHBondContact N-O 3.42Å; Q560-M569 PolarHBondContact O-N 3.23Å; D562-M569 HydrophobicContact CB-CE 3.95Å; M569-V571 PolarHBondContact O-N 3.02Å
570	K	90.4	Very high	81.7	Confident	92 Å²	92	70 Å²	70	40%	0.4	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	116	173.8	-170.1	175.7	-173.9	165.7	0	109.3	S557 Y559 E573	S557-K570 WeakPolarHBondContact OG-CE 3.23Å; S557-K570 PolarHBondContact OG-NZ 3.38Å; Y559-K570 HydrophobicContact CD1-CG 4.42Å; Y559-K570 HydrophobicContact CE2-CG 4.44Å; Y559-K570 HydrophobicContact CE1-CG 4.05Å; Y559-K570 HydrophobicContact CE1-CD 4.33Å; Y559-K570 HydrophobicContact CE1-CB 3.67Å; Y559-K570 HydrophobicContact CD1-CB 3.91Å; K570-E573 VanDerWaalsContact CE-OE2 3.28Å; K570-E573 WeakPolarHBondContact CE-OE2 2.88Å; K570-E573 IonicContact NZ-OE2 3.28Å; K570-E573 PolarHBondContact NZ-OE2 3.44Å
571	V	89.6	Confident	80.7	Confident	66 Å²	66	68.3 Å²	68.3	40%	0.4	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-24.7	-175.7	-65.6	0	0	0	0	113.3	L558 Q560 M569	L558-V571 HydrophobicContact CB-CG2 4.01Å; L558-V571 HydrophobicContact CD2-CG2 3.88Å; L558-V571 HydrophobicContact CG-CG2 3.9Å; L558-V571 WeakPolarHBondContact O-CG2 3.37Å; L558-V571 PolarHBondContact O-N 2.61Å; Q560-V571 HydrophobicContact CB-CG1 3.58Å; Q560-V571 HydrophobicContact CB-CG2 4.28Å; M569-V571 PolarHBondContact O-N 3.02Å
572	Y	85.6	Confident	79.5	Confident	40 Å²	40	68.4 Å²	68.4	16%	0.157	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	147	-179	-177.9	-96.4	0	0	0	111.7	L307 S557 L558 T574	L307-Y572 HydrophobicContact CD1-CE1 4.02Å; L307-Y572 HydrophobicContact CD2-CD1 3.93Å; L307-Y572 HydrophobicContact CD2-CE1 3.57Å; L307-Y572 HydrophobicContact CG-CE1 4.42Å; S557-Y572 CarbonylContact C-O 3.59Å; S557-Y572 WeakPolarHBondContact CA-O 3.46Å; L558-Y572 PolarHBondContact N-O 3.21Å; L558-Y572 PolarHBondContact O-N 2.86Å; Y572-T574 HydrophobicContact CE1-CG2 3.64Å
573	E	83.5	Confident	78.4	Confident	77 Å²	77	73.4 Å²	73.4	36%	0.36	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	128.2	170	-173.3	171.8	149.2	0	0	108.3	K555 K570	K555-E573 WeakPolarHBondContact CD-OE1 3.49Å; K555-E573 IonicContact NZ-OE1 2.75Å; K555-E573 PolarHBondContact NZ-OE1 3.5Å; K570-E573 VanDerWaalsContact CE-OE2 3.28Å; K570-E573 WeakPolarHBondContact CE-OE2 2.88Å; K570-E573 IonicContact NZ-OE2 3.28Å; K570-E573 PolarHBondContact NZ-OE2 3.44Å
574	T	73.5	Confident	77.6	Confident	9 Å²	9	75.4 Å²	75.4	6%	0.055	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-68.1	136.7	176.4	51.7	0	0	0	0	110.3	N556 Y572	N556-T574 HydrophobicContact CB-CG2 3.77Å; N556-T574 WeakPolarHBondContact CB-OG1 3.35Å; N556-T574 PolarHBondContact N-OG1 3.38Å; N556-T574 PolarHBondContact O-N 3.43Å; N556-T574 PolarHBondContact O-OG1 3.01Å; Y572-T574 HydrophobicContact CE1-CG2 3.64Å
575	P	68.3	Low	77.3	Confident	75 Å²	75	68.1 Å²	68.1	49%	0.487	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-54.7	149.6	164.8	-20.2	26.1	0	0	0	112.3	R577 L578	P575-R577 PolarHBondContact O-N 3.04Å; P575-L578 VanDerWaalsContact CD-CD1 3.44Å; P575-L578 HydrophobicContact CG-CD1 3.56Å; P575-L578 HydrophobicContact CB-CD1 3.69Å
576	D	60.5	Low	77	Confident	101 Å²	101	68.3 Å²	68.3	54%	0.54	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	137	-177.9	-71.2	-36.3	0	0	0	111.9	K555 L578	K555-D576 WeakPolarHBondContact CE-OD1 3.44Å; D576-L578 PolarHBondContact O-N 2.69Å
577	R	58.3	Low	77	Confident	245 Å²	245	66.7 Å²	66.7	93%	0.925	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	10.3	172.4	-51.9	178.4	177.1	-178.3	-0.6	118.2	P575 W579	P575-R577 PolarHBondContact O-N 3.04Å; R577-W579 PolarHBondContact O-N 2.63Å
578	L	56.1	Low	77	Confident	56 Å²	56	61.8 Å²	61.8	29%	0.293	29%	0.29	S	S	.	.	S	Bend	trans	-63.3	-41.5	-179.3	-103	155.7	0	0	0	113.6	V314 P575 D576	V314-L578 HydrophobicContact CB-CD2 4.47Å; V314-L578 HydrophobicContact CG2-CD2 4.11Å; P575-L578 VanDerWaalsContact CD-CD1 3.44Å; P575-L578 HydrophobicContact CG-CD1 3.56Å; P575-L578 HydrophobicContact CB-CD1 3.69Å; D576-L578 PolarHBondContact O-N 2.69Å
579	W	67.4	Low	77	Confident	38 Å²	38	61.8 Å²	61.8	14%	0.144	29%	0.293	C	S	.	.			trans	-165.5	143	175.1	43.7	-74.3	0	0	0	111.5	C290 P305 F537 R577 L581	C290-W579 HydrophobicContact CB-CH2 3.78Å; C290-W579 HydrophobicContact CB-CZ3 3.46Å; C290-W579 VanDerWaalsContact CB-CZ3 3.46Å; C290-W579 WeakPolarHBondContact SG-CH2 3.13Å; P305-W579 HydrophobicContact CB-CB 4.48Å; P305-W579 HydrophobicContact CB-CD2 3.73Å; P305-W579 HydrophobicContact CB-CE3 3.6Å; P305-W579 HydrophobicContact CB-CG 4.1Å; P305-W579 HydrophobicContact CB-CH2 4.47Å; P305-W579 HydrophobicContact CB-CZ3 3.93Å; P305-W579 HydrophobicContact CG-CD2 3.76Å; P305-W579 HydrophobicContact CG-CE3 3.09Å; P305-W579 HydrophobicContact CG-CG 4.36Å; P305-W579 HydrophobicContact CG-CH2 4.29Å; P305-W579 HydrophobicContact CG-CZ3 3.35Å; F537-W579 HydrophobicContact CE1-CH2 4.44Å; F537-W579 HydrophobicContact CE2-CH2 4.25Å; F537-W579 HydrophobicContact CE2-CZ2 4.48Å; F537-W579 AromaticContact CZ-CH2 3.61Å; F537-W579 HydrophobicContact CZ-CH2 3.61Å; F537-W579 HydrophobicContact CZ-CZ2 4Å; R577-W579 PolarHBondContact O-N 2.63Å; W579-L581 HydrophobicContact CE3-CD2 3.63Å; W579-L581 HydrophobicContact CZ3-CG 3.26Å; W579-L581 HydrophobicContact CZ3-CD2 3.34Å; W579-L581 HydrophobicContact CZ3-CD1 3.32Å; W579-L581 HydrophobicContact CH2-CG 4.24Å; W579-L581 HydrophobicContact CH2-CD1 3.83Å; W579-L581 VanDerWaalsContact CE3-CG 3.42Å; W579-L581 HydrophobicContact CE3-CG 3.42Å; W579-L581 HydrophobicContact CE3-CD1 3.95Å
580	D	65.8	Low	77	Confident	56 Å²	56	58 Å²	58	30%	0.299	27%	0.274	S	S	.	.			trans	-100	108	-178.3	-172.1	14.1	0	0	0	111.2	R554	R554-D580 WeakPolarHBondContact CD-OD1 3.27Å; R554-D580 IonicContact CZ-OD1 3.71Å; R554-D580 IonicContact CZ-OD2 2.82Å; R554-D580 IonicContact NE-OD1 3.07Å; R554-D580 IonicContact NH1-OD1 3.75Å; R554-D580 PolarHBondContact NH1-OD1 3.19Å; R554-D580 IonicContact NH1-OD2 3.48Å; R554-D580 PolarHBondContact NH1-OD2 3.46Å
581	L	72.1	Confident	76.9	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	28%	0.276	C	S	.	.			trans	-82.9	140.5	176.3	-80.7	177.1	0	0	0	112.1	C290 A293 F537 R539 W579 F585	C290-L581 HydrophobicContact CB-CD2 3.93Å; A293-L581 HydrophobicContact CB-CD2 4.25Å; F537-L581 HydrophobicContact CE1-CD1 3.55Å; F537-L581 HydrophobicContact CZ-CD1 4.04Å; R539-L581 VanDerWaalsContact CD-CB 3.4Å; R539-L581 HydrophobicContact CG-CB 4.46Å; R539-L581 PolarHBondContact NH1-O 2.92Å; W579-L581 HydrophobicContact CE3-CD2 3.63Å; W579-L581 HydrophobicContact CZ3-CG 3.26Å; W579-L581 HydrophobicContact CZ3-CD2 3.34Å; W579-L581 HydrophobicContact CZ3-CD1 3.32Å; W579-L581 HydrophobicContact CH2-CG 4.24Å; W579-L581 HydrophobicContact CH2-CD1 3.83Å; W579-L581 VanDerWaalsContact CE3-CG 3.42Å; W579-L581 HydrophobicContact CE3-CG 3.42Å; W579-L581 HydrophobicContact CE3-CD1 3.95Å; L581-F585 HydrophobicContact CB-CD1 4.27Å; L581-F585 HydrophobicContact CG-CG 4.41Å; L581-F585 HydrophobicContact CD2-CG 4.15Å; L581-F585 HydrophobicContact CD2-CD2 4.38Å; L581-F585 HydrophobicContact CD2-CB 3.82Å; L581-F585 HydrophobicContact CD1-CZ 4.29Å; L581-F585 HydrophobicContact CD1-CG 4.03Å; L581-F585 HydrophobicContact CD1-CE1 4.44Å; L581-F585 HydrophobicContact CD1-CD2 3.85Å; L581-F585 HydrophobicContact CD1-CD1 4.34Å; L581-F585 HydrophobicContact CB-CG 4.33Å; L581-F585 HydrophobicContact CB-CB 4.45Å; L581-F585 HydrophobicContact CD1-CE2 3.99Å
582	G	67.8	Low	76.9	Confident	4 Å²	4	55.4 Å²	55.4	4%	0.041	26%	0.258	C	S	.	.			trans	-68.9	-178.5	174.4	0	0	0	0	0	113.7	A294 R539 F585	A294-G582 VanDerWaalsContact CB-CA 3.49Å; R539-G582 VanDerWaalsContact CZ-O 3.22Å; R539-G582 PolarHBondContact NE-O 3.13Å; G582-F585 WeakPolarHBondContact O-CD1 3.34Å
583	R	69	Low	76.9	Confident	150 Å²	150	54 Å²	54	57%	0.566	25%	0.252	S	S	*	.	S	Bend	trans	-79.2	-22.2	173.5	-67.3	-173.7	-71.7	-168.2	3.6	113.2	Y524	Y524-R583 HydrophobicContact CD1-CB 4.43Å; Y524-R583 WeakPolarHBondContact CD1-O 3.42Å; Y524-R583 HydrophobicContact CE1-CB 3.75Å; Y524-R583 HydrophobicContact CE1-CG 4.11Å; Y524-R583 WeakPolarHBondContact CE1-O 3.35Å; Y524-R583 HydrophobicContact CE2-CG 4.08Å; Y524-R583 WeakPolarHBondContact OH-CD 3.4Å; Y524-R583 WeakPolarHBondContact OH-CG 3.34Å
584	H	72.4	Confident	77	Confident	95 Å²	95	51.8 Å²	51.8	44%	0.44	24%	0.244	S	C	.	.	S	Bend	trans	-111.3	19.6	-175	-56.6	-75.1	0	0	0	112.1	E326	E326-H584 HydrophobicContact CG-CB 4.48Å; E326-H584 IonicContact OE1-ND1 3.97Å
585	F	82.4	Confident	77.3	Confident	1 Å²	1	58 Å²	58	0%	0.004	27%	0.273	C	S	.	.			trans	-58.8	147.3	177.1	80.7	-84.7	0	0	0	110.1	F291 K526 F537 R539 L581 G582 C587	F291-F585 WeakPolarHBondContact O-CA 3.4Å; F291-F585 VanDerWaalsContact O-CB 3.25Å; F291-F585 WeakPolarHBondContact O-CB 3.22Å; K526-F585 HydrophobicContact CB-CE2 4.21Å; K526-F585 WeakPolarHBondContact CE-O 3.43Å; K526-F585 HydrophobicContact CG-CD2 4.05Å; K526-F585 HydrophobicContact CG-CE2 3.48Å; K526-F585 VanDerWaalsContact CG-CE2 3.48Å; K526-F585 HydrophobicContact CG-CZ 3.89Å; F537-F585 AromaticContact CD1-CE2 3.66Å; F537-F585 HydrophobicContact CD1-CE2 3.66Å; F537-F585 AromaticContact CD1-CZ 3.9Å; F537-F585 HydrophobicContact CD1-CZ 3.9Å; F537-F585 AromaticContact CE1-CE2 3.98Å; F537-F585 HydrophobicContact CE1-CE2 3.98Å; F537-F585 HydrophobicContact CE1-CZ 4.23Å; R539-F585 HydrophobicContact CB-CE1 3.73Å; R539-F585 HydrophobicContact CB-CZ 3.95Å; R539-F585 HydrophobicContact CG-CE1 4.47Å; L581-F585 HydrophobicContact CB-CD1 4.27Å; L581-F585 HydrophobicContact CG-CG 4.41Å; L581-F585 HydrophobicContact CD2-CG 4.15Å; L581-F585 HydrophobicContact CD2-CD2 4.38Å; L581-F585 HydrophobicContact CD2-CB 3.82Å; L581-F585 HydrophobicContact CD1-CZ 4.29Å; L581-F585 HydrophobicContact CD1-CG 4.03Å; L581-F585 HydrophobicContact CD1-CE1 4.44Å; L581-F585 HydrophobicContact CD1-CD2 3.85Å; L581-F585 HydrophobicContact CD1-CD1 4.34Å; L581-F585 HydrophobicContact CB-CG 4.33Å; L581-F585 HydrophobicContact CB-CB 4.45Å; L581-F585 HydrophobicContact CD1-CE2 3.99Å; G582-F585 WeakPolarHBondContact O-CD1 3.34Å; F585-C587 VanDerWaalsContact CE2-SG 3.5Å
586	E	85.7	Confident	77.9	Confident	54 Å²	54	56 Å²	56	25%	0.252	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	150.1	172.1	-71.6	-65.7	162.9	0	0	109	C290 F291 I329 K526	C290-E586 CarbonylContact C-O 3.57Å; C290-E586 WeakPolarHBondContact CA-O 3.27Å; F291-E586 PolarHBondContact N-O 2.95Å; F291-E586 PolarHBondContact O-N 2.92Å; I329-E586 HydrophobicContact CD1-CB 3.53Å; I329-E586 HydrophobicContact CD1-CG 4.37Å; K526-E586 WeakPolarHBondContact CD-OE2 3.38Å; K526-E586 WeakPolarHBondContact CE-OE2 3.39Å; K526-E586 IonicContact NZ-OE1 2.63Å; K526-E586 PolarHBondContact NZ-OE1 3.04Å; K526-E586 IonicContact NZ-OE2 3.46Å; K526-E586 PolarHBondContact NZ-OE2 3.25Å
587	C	90.2	Very high	79	Confident	20 Å²	20	51.8 Å²	51.8	14%	0.135	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.7	178.7	-66.2	0	0	0	0	110.9	I288 I289 C290 K526 V528 F585	I288-C587 HydrophobicContact CG2-CB 4.25Å; I289-C587 CarbonylContact O-C 3.57Å; I289-C587 VanDerWaalsContact O-CA 3.26Å; I289-C587 WeakPolarHBondContact O-CA 3.47Å; C290-C587 PolarHBondContact SG-SG 3.48Å; K526-C587 HydrophobicContact CB-CB 3.88Å; K526-C587 HydrophobicContact CG-CB 4.32Å; V528-C587 HydrophobicContact CG1-CB 3.58Å; F585-C587 VanDerWaalsContact CE2-SG 3.5Å
588	A	92.4	Very high	79.9	Confident	10 Å²	10	45.7 Å²	45.7	8%	0.083	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	156	168	0	0	0	0	0	109.4	I289 F291 I329 V331	I289-A588 PolarHBondContact N-O 2.57Å; I289-A588 PolarHBondContact O-N 3.47Å; F291-A588 HydrophobicContact CE2-CB 4.23Å; I329-A588 HydrophobicContact CG2-CB 3.79Å; V331-A588 HydrophobicContact CG2-CB 3.99Å
589	V	93	Very high	80.4	Confident	24 Å²	24	50.7 Å²	50.7	15%	0.145	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.2	175	178.7	0	0	0	0	107.8	E286 M287 I288 V331 V528 L529 F530	E286-V589 HydrophobicContact CG-CG1 3.52Å; E286-V589 WeakPolarHBondContact OE1-CG1 3.19Å; M287-V589 WeakPolarHBondContact O-CA 3.41Å; I288-V589 HydrophobicContact CG1-CG2 4.16Å; V331-V589 WeakPolarHBondContact CG2-O 3.01Å; V528-V589 HydrophobicContact CB-CG2 3.69Å; V528-V589 HydrophobicContact CG1-CG2 4.09Å; V528-V589 HydrophobicContact CG2-CG2 4.2Å; L529-V589 WeakPolarHBondContact O-CG2 3.23Å; F530-V589 HydrophobicContact CD2-CG1 4.04Å
590	A	92.6	Very high	80	Confident	3 Å²	3	50.7 Å²	50.7	3%	0.025	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	156.3	176.5	0	0	0	0	0	109.9	M287 I289 V331 I337 L592	M287-A590 PolarHBondContact N-O 2.62Å; M287-A590 PolarHBondContact O-N 2.82Å; I289-A590 HydrophobicContact CD1-CB 3.96Å; V331-A590 HydrophobicContact CG1-CB 3.9Å; V331-A590 HydrophobicContact CG2-CB 4.19Å; I337-A590 HydrophobicContact CD1-CB 3.68Å; I337-A590 HydrophobicContact CG1-CB 3.8Å; A590-L592 PolarHBondContact O-N 2.84Å
591	K	89.3	Confident	79	Confident	103 Å²	103	57.7 Å²	57.7	45%	0.448	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	117.1	168.6	-61.2	-179.3	178.4	-178.7	0	108.5	A284 S285 E286 N335	A284-K591 HydrophobicContact CB-CB 4.28Å; S285-K591 WeakPolarHBondContact O-CA 3.28Å; E286-K591 HydrophobicContact CB-CG 4.49Å; N335-K591 PolarHBondContact ND2-O 3.11Å; N335-K591 PolarHBondContact OD1-N 3.21Å
592	L	88.6	Confident	79.4	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	152	178.1	-63.5	-178.9	0	0	0	110.4	A284 S285 M287 I289 C306 L317 I337 Y363 A590 P594 L597	A284-L592 WeakPolarHBondContact CA-O 3.36Å; S285-L592 PolarHBondContact N-O 3.47Å; S285-L592 PolarHBondContact O-N 2.79Å; M287-L592 HydrophobicContact CB-CD1 4.33Å; M287-L592 HydrophobicContact SD-CB 4.11Å; M287-L592 HydrophobicContact SD-CD1 4.21Å; I289-L592 HydrophobicContact CD1-CD1 3.77Å; I289-L592 HydrophobicContact CD1-CD2 4.14Å; I289-L592 HydrophobicContact CD1-CG 4.17Å; I289-L592 HydrophobicContact CG1-CD1 3.85Å; C306-L592 HydrophobicContact CB-CD1 3.93Å; C306-L592 VanDerWaalsContact SG-CD1 3.52Å; L317-L592 HydrophobicContact CD1-CD1 4.17Å; L317-L592 HydrophobicContact CD1-CD2 4.41Å; I337-L592 HydrophobicContact CD1-CD2 3.78Å; Y363-L592 HydrophobicContact CE1-CD2 4.05Å; A590-L592 PolarHBondContact O-N 2.84Å; L592-P594 VanDerWaalsContact O-CD 3.31Å; L592-P594 WeakPolarHBondContact O-CD 3.5Å; L592-L597 HydrophobicContact CB-CD1 4.01Å; L592-L597 HydrophobicContact CD1-CD1 3.95Å
593	Y	86.9	Confident	80	Confident	12 Å²	12	63.5 Å²	63.5	5%	0.047	31%	0.306	C	S	.	.			trans	-90.9	109.8	176.2	-51.8	-74.6	0	0	0	110.1	N206 L280 A284 H365 Q595 C596 L597	N206-Y593 PolarHBondContact ND2-OH 3.2Å; N206-Y593 PolarHBondContact OD1-OH 3.2Å; L280-Y593 HydrophobicContact CD1-CD1 3.92Å; L280-Y593 HydrophobicContact CD1-CG 3.94Å; L280-Y593 HydrophobicContact CG-CD1 3.85Å; L280-Y593 HydrophobicContact CG-CE1 3.95Å; L280-Y593 HydrophobicContact CG-CG 4.16Å; L280-Y593 WeakPolarHBondContact O-CD1 3.39Å; L280-Y593 VanDerWaalsContact O-CE1 3.31Å; L280-Y593 WeakPolarHBondContact O-CE1 3.38Å; A284-Y593 HydrophobicContact CB-CD1 3.89Å; A284-Y593 HydrophobicContact CB-CE1 3.63Å; H365-Y593 HydrophobicContact CB-CD2 3.67Å; H365-Y593 HydrophobicContact CB-CE2 3.49Å; H365-Y593 VanDerWaalsContact CB-CE2 3.49Å; Y593-Q595 PolarHBondContact O-N 2.82Å; Y593-C596 PolarHBondContact O-N 2.81Å; Y593-L597 WeakPolarHBondContact O-CG 3.48Å; Y593-L597 PolarHBondContact O-N 2.75Å
594	P	84.1	Confident	80.6	Confident	29 Å²	29	58.7 Å²	58.7	19%	0.188	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.9	179.5	-23.3	33.1	0	0	0	113.4	T283 M287 F315 L592	T283-P594 WeakPolarHBondContact O-CD 3.32Å; M287-P594 HydrophobicContact CE-CB 4.33Å; M287-P594 HydrophobicContact CE-CG 3.7Å; F315-P594 HydrophobicContact CD1-CB 4.5Å; F315-P594 HydrophobicContact CE1-CB 3.76Å; F315-P594 HydrophobicContact CE2-CB 4.48Å; F315-P594 HydrophobicContact CZ-CB 3.75Å; F315-P594 HydrophobicContact CZ-CG 4.44Å; L592-P594 VanDerWaalsContact O-CD 3.31Å; L592-P594 WeakPolarHBondContact O-CD 3.5Å
595	Q	80.9	Confident	81	Confident	140 Å²	140	56.6 Å²	56.6	65%	0.654	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-31.2	180	-59.4	-174	-1.8	0	0	112.8	Y593	Y593-Q595 PolarHBondContact O-N 2.82Å
596	C	81.3	Confident	81	Confident	32 Å²	32	60.1 Å²	60.1	22%	0.216	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-12.1	180	-57.7	0	0	0	0	112.7	H365 N368 Y593	H365-C596 WeakPolarHBondContact O-CB 2.87Å; N368-C596 WeakPolarHBondContact CB-O 3.5Å; N368-C596 PolarHBondContact ND2-O 3.48Å; Y593-C596 PolarHBondContact O-N 2.81Å
597	L	82.7	Confident	80.6	Confident	13 Å²	13	60.5 Å²	60.5	7%	0.068	30%	0.304	C	S	.	.	S	Bend	trans	-92	153.4	-178.2	-62.8	177.1	0	0	0	112.4	M287 F315 L317 Y363 L592 Y593 K599	M287-L597 HydrophobicContact CE-CD1 4.47Å; M287-L597 HydrophobicContact SD-CD1 4.1Å; F315-L597 HydrophobicContact CB-CB 3.94Å; F315-L597 HydrophobicContact CB-CD1 3.56Å; F315-L597 HydrophobicContact CB-CG 4.41Å; F315-L597 HydrophobicContact CD1-CB 4.21Å; F315-L597 HydrophobicContact CG-CB 4.4Å; F315-L597 HydrophobicContact CG-CD1 4.02Å; L317-L597 HydrophobicContact CB-CD2 4.23Å; Y363-L597 WeakPolarHBondContact OH-CD2 3.36Å; L592-L597 HydrophobicContact CB-CD1 4.01Å; L592-L597 HydrophobicContact CD1-CD1 3.95Å; Y593-L597 WeakPolarHBondContact O-CG 3.48Å; Y593-L597 PolarHBondContact O-N 2.75Å; L597-K599 PolarHBondContact O-N 3.15Å
598	Q	77.4	Confident	80	Confident	118 Å²	118	63.4 Å²	63.4	55%	0.551	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	124	171.2	-69.5	-179.4	0.7	0	0	109.3	K316	K316-Q598 HydrophobicContact CB-CB 3.99Å; K316-Q598 PolarHBondContact N-O 2.86Å; K316-Q598 PolarHBondContact O-N 3.24Å; K316-Q598 VanDerWaalsContact O-N 3.17Å
599	K	66.3	Low	79	Confident	160 Å²	160	67.5 Å²	67.5	70%	0.696	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	132.9	173.6	-67.9	-179.9	-178	173.4	0	109.8	F315 L597	F315-K599 HydrophobicContact CD1-CG 4.33Å; F315-K599 HydrophobicContact CE1-CG 4.23Å; L597-K599 PolarHBondContact O-N 3.15Å
600	V	58.9	Low	77.8	Confident	38 Å²	38	71.1 Å²	71.1	23%	0.23	35%	0.35	C	S	.	.			trans	-85.2	-41.2	179	-173.7	0	0	0	0	110.9	V314 K316	V314-V600 HydrophobicContact CG1-CG2 4.3Å; V314-V600 WeakPolarHBondContact O-CG2 3.43Å; K316-V600 HydrophobicContact CB-CG2 4.06Å; K316-V600 HydrophobicContact CD-CB 4.42Å; K316-V600 HydrophobicContact CD-CG1 4.46Å; K316-V600 HydrophobicContact CD-CG2 3.47Å; K316-V600 VanDerWaalsContact CD-CG2 3.47Å; K316-V600 VanDerWaalsContact CE-CG2 3.42Å; K316-V600 HydrophobicContact CG-CG2 3.32Å
601	L	45.1	Very low	76.5	Confident	204 Å²	204	77.3 Å²	77.3	100%	1.068	38%	0.379	S	S	*	.			trans	-156.2	0	176.5	-81.6	166	0	0	0	108.5

Retrieved 601 of 601 residues in 327.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).