G5EA30_HUMAN Loading...

CUG triplet repeat, RNA binding protein 1, isoform CRA_c

AlphaFold DB , UniProt , Accession G5EA30, Species HUMAN (Homo sapiens, Human), Gene CELF1, Length 514 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.3	Very low	36.5	Very low	253 Å²	253	154.5 Å²	154.5	100%	1.246	82%	0.815	S	S	*	*				0	149.5	0	-76.4	164.6	167.1	0	0	108.1
2	A	36.6	Very low	36.1	Very low	108 Å²	108	157.4 Å²	157.4	89%	0.893	83%	0.825	S	S	*	*			trans	-87.3	167.2	-167.9	0	0	0	0	0	113.7
3	A	41.9	Very low	36	Very low	79 Å²	79	156.7 Å²	156.7	65%	0.653	82%	0.818	S	S	*	*			trans	-128.7	-174.9	172.4	0	0	0	0	0	109.8
4	F	33.5	Very low	35.9	Very low	201 Å²	201	154 Å²	154	88%	0.882	81%	0.811	S	S	*	*			trans	72.7	151.5	-176.1	-52.1	-79.9	0	0	0	114.2
5	K	35.1	Very low	35.5	Very low	166 Å²	166	153 Å²	153	72%	0.722	81%	0.806	S	S	*	*			cis	-152.4	167.2	0	-145.8	-169.1	170.3	-146.9	0	111.2	D7	K5-D7 IonicContact NZ-OD2 2.64Å; K5-D7 PolarHBondContact NZ-OD2 2.64Å
6	L	34.5	Very low	35.3	Very low	148 Å²	148	153.6 Å²	153.6	78%	0.775	80%	0.803	S	S	*	*			trans	-72.6	158.3	152.3	-75.7	77.5	0	0	0	110.1
7	D	35.4	Very low	34.8	Very low	120 Å²	120	150.6 Å²	150.6	64%	0.642	80%	0.797	S	S	*	*				170	114.4	125.7	-83.9	-33.2	0	0	0	111.4	K5	K5-D7 IonicContact NZ-OD2 2.64Å; K5-D7 PolarHBondContact NZ-OD2 2.64Å
8	F	33.6	Very low	34.4	Very low	206 Å²	206	148.3 Å²	148.3	90%	0.904	79%	0.794	S	S	*	*				-176.8	150.4	122.1	-123.6	-106.4	0	0	0	113.9
9	L	32.6	Very low	34.1	Very low	139 Å²	139	149.1 Å²	149.1	73%	0.728	80%	0.798	S	S	*	*			trans	-133.5	157.4	174	-110.8	169.1	0	0	0	106.7
10	P	45.1	Very low	33.7	Very low	119 Å²	119	148.8 Å²	148.8	77%	0.773	80%	0.796	S	S	*	*				-148.7	-174.2	72.6	38.9	-17.7	0	0	0	116
11	E	31.9	Very low	33.4	Very low	160 Å²	160	147.1 Å²	147.1	75%	0.748	80%	0.796	S	S	*	*			trans	-79.5	166.1	-174	-54.8	157	79.5	0	0	114.8
12	M	31.7	Very low	32.9	Very low	190 Å²	190	140.3 Å²	140.3	94%	0.936	77%	0.774	S	S	*	*				-162.5	160.5	112.4	-102.5	-155	-61.1	0	0	112.9
13	M	34.3	Very low	33	Very low	148 Å²	148	140.9 Å²	140.9	73%	0.729	77%	0.768	S	S	*	*			trans	-88.7	145	-174.7	-70	158.1	58.4	0	0	112.1
14	V	34.5	Very low	32.5	Very low	119 Å²	119	143 Å²	143	72%	0.721	77%	0.773	S	S	*	*				44.3	116	97.4	-160.7	0	0	0	0	114.5
15	D	29.6	Very low	32.4	Very low	139 Å²	139	138.8 Å²	138.8	74%	0.743	77%	0.768	S	S	*	*				174.5	178.5	118.9	-106.9	-59.8	0	0	0	116.6
16	H	32.3	Very low	32.3	Very low	162 Å²	162	141 Å²	141	75%	0.75	78%	0.778	S	S	*	*			trans	-82.7	150.1	-154.6	-85	-89	0	0	0	121.7
17	C	27.3	Very low	32.4	Very low	104 Å²	104	143 Å²	143	70%	0.703	78%	0.78	S	S	*	*			trans	61.9	126.5	134.1	-66.7	0	0	0	0	126.1
18	S	27.3	Very low	32.8	Very low	108 Å²	108	144.7 Å²	144.7	76%	0.755	79%	0.786	S	S	*	*				89.2	127.3	129	-68.6	0	0	0	0	124.6
19	L	28.7	Very low	33	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	77%	0.773	S	S	*	*			trans	79.3	106	143.8	-69.1	169.6	0	0	0	123.5
20	N	27.5	Very low	33	Very low	143 Å²	143	136.1 Å²	136.1	77%	0.765	76%	0.762	S	S	*	*				75.9	111.4	121	-168.5	38.7	0	0	0	122.3
21	S	26.8	Very low	32.3	Very low	114 Å²	114	137 Å²	137	80%	0.797	77%	0.766	S	S	*	*			trans	-179	153.2	130.5	38.7	0	0	0	0	113.3
22	S	29.8	Very low	32.8	Very low	111 Å²	111	136.8 Å²	136.8	78%	0.776	77%	0.768	S	S	*	*			trans	-108.5	165.9	172.3	-43.5	0	0	0	0	109.9
23	P	38.6	Very low	33.1	Very low	119 Å²	119	134.8 Å²	134.8	77%	0.773	76%	0.761	S	S	*	*				-162.3	-176.6	83.9	42.6	-20.5	0	0	0	118.8
24	V	32.8	Very low	33.4	Very low	124 Å²	124	135.4 Å²	135.4	75%	0.752	76%	0.762	S	S	*	*			trans	74.3	89.4	159.2	-165.8	0	0	0	0	121.4
25	S	31	Very low	34.1	Very low	113 Å²	113	134.3 Å²	134.3	79%	0.79	76%	0.758	S	S	*	*				49.4	125.3	118.1	-49.8	0	0	0	0	124.3
26	K	32.8	Very low	35.3	Very low	212 Å²	212	132.4 Å²	132.4	92%	0.922	75%	0.748	S	S	*	*			trans	-150.5	119.2	131.5	-120.2	172.8	-175.5	175.2	0	112.8
27	K	35.8	Very low	36.5	Very low	189 Å²	189	132.2 Å²	132.2	82%	0.822	75%	0.747	S	S	*	*			trans	-83.6	169.2	159.5	-64.9	-179.1	172.5	-177.4	0	108
28	M	44.1	Very low	38.3	Very low	156 Å²	156	129 Å²	129	77%	0.768	73%	0.725	S	S	*	*			cis	-162	176	2.8	-132	161.9	146.9	0	0	106
29	N	38.4	Very low	40.3	Very low	117 Å²	117	128.2 Å²	128.2	63%	0.626	71%	0.712	S	S	*	*			cis	-157.8	161.6	0.8	-163.1	50.8	0	0	0	106.6
30	G	32	Very low	42	Very low	48 Å²	48	129.2 Å²	129.2	50%	0.495	72%	0.718	S	S	.	*			cis	128.4	85.7	-3.4	0	0	0	0	0	112.9
31	T	30.5	Very low	43.9	Very low	139 Å²	139	126 Å²	126	85%	0.853	70%	0.7	S	S	*	*			trans	-70.1	127.6	169.3	35.3	0	0	0	0	110.5	D33	T31-D33 PolarHBondContact O-N 3.33Å
32	L	42.3	Very low	46.3	Very low	154 Å²	154	121.9 Å²	121.9	81%	0.806	67%	0.673	S	S	*	*			trans	-98.1	84.1	-174.7	-68.7	166.6	0	0	0	110.6
33	D	39.3	Very low	48.7	Very low	148 Å²	148	118.7 Å²	118.7	79%	0.791	65%	0.647	S	S	*	*			trans	-88.9	139	162.5	-87	-78.8	0	0	0	110	T31 P35	T31-D33 PolarHBondContact O-N 3.33Å; D33-P35 WeakPolarHBondContact O-CD 3.48Å
34	H	40.3	Very low	51.1	Low	161 Å²	161	115 Å²	115	75%	0.745	62%	0.619	S	S	*	*			trans	-70.7	122.1	-166.3	-77.5	-96.9	0	0	0	112.6	D36	H34-D36 PolarHBondContact O-N 3.23Å; H34-D36 VanDerWaalsContact O-N 3.15Å
35	P	49.4	Very low	53.8	Low	96 Å²	96	109.1 Å²	109.1	62%	0.623	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	12.7	179.1	34.9	-36.8	0	0	0	113.9	D33 Y94	D33-P35 WeakPolarHBondContact O-CD 3.48Å; P35-Y94 WeakPolarHBondContact O-CE1 3.31Å; P35-Y94 PolarHBondContact O-OH 2.97Å
36	D	54.9	Low	56.7	Low	100 Å²	100	106.8 Å²	106.8	54%	0.535	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	9.2	-170.7	-67.1	-67.8	0	0	0	114.6	H34 Y70	H34-D36 PolarHBondContact O-N 3.23Å; H34-D36 VanDerWaalsContact O-N 3.15Å; D36-Y70 WeakPolarHBondContact O-CE2 3.45Å; D36-Y70 PolarHBondContact O-OH 3.39Å
37	Q	56.9	Low	59.5	Low	157 Å²	157	96.7 Å²	96.7	73%	0.734	52%	0.515	S	S	*	.			trans	-112.4	123.2	178.1	-144.8	85.6	111.3	0	0	110.9
38	P	65.6	Low	62	Low	37 Å²	37	88 Å²	88	24%	0.24	48%	0.479	C	S	.	.			trans	-73.6	159.6	170.5	33.3	-34.6	0	0	0	110.5	A42 Y70	P38-A42 HydrophobicContact CB-CB 3.8Å; P38-Y70 HydrophobicContact CB-CD1 4.27Å; P38-Y70 HydrophobicContact CB-CG 4.22Å; P38-Y70 HydrophobicContact CG-CD1 4.09Å; P38-Y70 HydrophobicContact CG-CE1 3.98Å; P38-Y70 HydrophobicContact CG-CG 4.45Å
39	D	68.4	Low	64.1	Low	91 Å²	91	83.2 Å²	83.2	49%	0.487	46%	0.455	S	S	.	.			trans	-62.1	155.5	179.4	-168.7	6.3	0	0	0	112.1	D41 A42 Y94	D39-D41 PolarHBondContact O-N 3.02Å; D39-D41 VanDerWaalsContact O-N 3.12Å; D39-A42 WeakPolarHBondContact O-CB 3.46Å; D39-A42 PolarHBondContact O-N 3.26Å; D39-Y94 WeakPolarHBondContact CB-O 3.4Å; D39-Y94 PolarHBondContact N-O 2.81Å
40	L	63.9	Low	66.5	Low	185 Å²	185	77.8 Å²	77.8	97%	0.969	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-21	179.4	-80.6	161.4	0	0	0	113.5
41	D	68.6	Low	69	Low	74 Å²	74	75.7 Å²	75.7	40%	0.396	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	7.4	176	-168.4	41.4	0	0	0	112.6	D39 I43 R96	D39-D41 PolarHBondContact O-N 3.02Å; D39-D41 VanDerWaalsContact O-N 3.12Å; D41-I43 WeakPolarHBondContact O-CG1 3.45Å; D41-I43 PolarHBondContact O-N 3.49Å; D41-R96 WeakPolarHBondContact O-CB 3.45Å; D41-R96 VanDerWaalsContact OD1-CD 3.3Å; D41-R96 WeakPolarHBondContact OD1-CD 3.48Å; D41-R96 IonicContact OD1-CZ 2.69Å; D41-R96 IonicContact OD1-NE 2.7Å; D41-R96 IonicContact OD1-NH1 3.66Å; D41-R96 PolarHBondContact OD1-NH1 3.41Å; D41-R96 VanDerWaalsContact OD2-CB 3.29Å; D41-R96 WeakPolarHBondContact OD2-CB 3.21Å; D41-R96 WeakPolarHBondContact OD2-CD 3.27Å; D41-R96 IonicContact OD2-NH1 2.62Å
42	A	77.2	Confident	71.5	Confident	28 Å²	28	76.1 Å²	76.1	23%	0.231	39%	0.389	C	S	.	.			trans	-60.3	133.6	179.2	0	0	0	0	0	112	P38 D39 F93	P38-A42 HydrophobicContact CB-CB 3.8Å; D39-A42 WeakPolarHBondContact O-CB 3.46Å; D39-A42 PolarHBondContact O-N 3.26Å; A42-F93 WeakPolarHBondContact CB-O 3.26Å
43	I	80.8	Confident	73.5	Confident	45 Å²	45	74.7 Å²	74.7	23%	0.231	39%	0.387	C	S	.	.			trans	-117.3	125.5	-178.1	-59.6	-168.6	0	0	0	110.3	D41 M45 R96 P123	D41-I43 WeakPolarHBondContact O-CG1 3.45Å; D41-I43 PolarHBondContact O-N 3.49Å; I43-M45 HydrophobicContact CG2-SD 3.72Å; I43-R96 HydrophobicContact CD1-CG 3.77Å; I43-R96 HydrophobicContact CG1-CG 4.08Å; I43-P123 HydrophobicContact CG2-CB 4.28Å
44	K	87.8	Confident	75.7	Confident	40 Å²	40	70.4 Å²	70.4	17%	0.174	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.6	166.4	-164.8	154.5	-169.1	154.5	0	110	E71 F90 T92 A124 E127	K44-E71 WeakPolarHBondContact CE-OE2 3.35Å; K44-E71 IonicContact NZ-OE1 2.81Å; K44-E71 PolarHBondContact NZ-OE1 2.98Å; K44-E71 IonicContact NZ-OE2 2.9Å; K44-E71 PolarHBondContact NZ-OE2 3.28Å; K44-F90 HydrophobicContact CG-CB 4.19Å; K44-F90 HydrophobicContact CG-CD1 4.41Å; K44-T92 WeakPolarHBondContact CG-OG1 3.44Å; K44-A124 HydrophobicContact CB-CB 4.37Å; K44-A124 HydrophobicContact CG-CB 4.37Å; K44-A124 WeakPolarHBondContact O-CB 3.43Å; K44-A124 PolarHBondContact O-N 3.4Å; K44-E127 WeakPolarHBondContact CB-OE2 3.29Å
45	M	90.3	Very high	77.9	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.5	-178.1	-57.9	-65.9	-80	0	0	109.6	I43 F90 V91 A99 Q103 M121 K122 P123	I43-M45 HydrophobicContact CG2-SD 3.72Å; M45-F90 CarbonylContact O-C 3.43Å; M45-F90 VanDerWaalsContact O-CA 3.29Å; M45-F90 WeakPolarHBondContact O-CA 3.36Å; M45-V91 HydrophobicContact CB-CG1 3.99Å; M45-V91 PolarHBondContact N-O 3.25Å; M45-V91 PolarHBondContact O-N 3.15Å; M45-A99 HydrophobicContact CG-CB 3.87Å; M45-A99 HydrophobicContact SD-CB 4.22Å; M45-Q103 HydrophobicContact CE-CB 3.83Å; M45-Q103 HydrophobicContact CE-CG 4.06Å; M45-M121 HydrophobicContact CB-CE 3.78Å; M45-M121 HydrophobicContact CB-CG 4.43Å; M45-M121 HydrophobicContact CE-CE 4.01Å; M45-M121 HydrophobicContact CE-CG 4.08Å; M45-M121 HydrophobicContact CG-CE 3.76Å; M45-K122 CarbonylContact C-O 3.45Å; M45-K122 VanDerWaalsContact CA-O 3.31Å; M45-K122 WeakPolarHBondContact CA-O 3.32Å; M45-P123 HydrophobicContact CE-CG 4.3Å; M45-P123 HydrophobicContact SD-CB 4.27Å; M45-P123 HydrophobicContact SD-CG 4.17Å
46	F	92	Very high	79.8	Confident	65 Å²	65	63.2 Å²	63.2	29%	0.285	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	138.4	165.3	175.5	-99.8	0	0	0	110.1	C88 F90 M121 K122 A124	F46-C88 HydrophobicContact CE2-CB 3.64Å; F46-C88 HydrophobicContact CZ-CB 3.64Å; F46-F90 HydrophobicContact CB-CD1 4.06Å; F46-F90 HydrophobicContact CB-CE1 3.83Å; F46-F90 HydrophobicContact CD2-CD1 4.21Å; F46-F90 AromaticContact CD2-CE1 3.71Å; F46-F90 HydrophobicContact CD2-CE1 3.71Å; F46-F90 AromaticContact CD2-CZ 3.96Å; F46-F90 HydrophobicContact CD2-CZ 3.96Å; F46-F90 HydrophobicContact CG-CE1 4.25Å; F46-M121 CarbonylContact O-C 3.54Å; F46-M121 VanDerWaalsContact O-CA 3.3Å; F46-M121 WeakPolarHBondContact O-CA 3.4Å; F46-K122 PolarHBondContact N-O 2.73Å; F46-K122 PolarHBondContact O-N 2.82Å; F46-A124 HydrophobicContact CB-CB 4.42Å
47	V	91	Very high	81.4	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	108.6	178.1	-178.7	0	0	0	0	108.5	V50 F63 C88 C89 V91 I119 M121	V47-V50 HydrophobicContact CG1-CG2 3.7Å; V47-F63 HydrophobicContact CB-CZ 4.29Å; V47-F63 HydrophobicContact CG1-CZ 3.83Å; V47-F63 HydrophobicContact CG2-CE1 4.26Å; V47-F63 HydrophobicContact CG2-CE2 4.31Å; V47-F63 HydrophobicContact CG2-CZ 3.64Å; V47-C88 CarbonylContact O-C 3.38Å; V47-C88 WeakPolarHBondContact O-CA 3.45Å; V47-C88 WeakPolarHBondContact O-CB 3.21Å; V47-C89 PolarHBondContact N-O 2.97Å; V47-C89 PolarHBondContact O-N 3.38Å; V47-V91 HydrophobicContact CG2-CG1 3.69Å; V47-I119 HydrophobicContact CG1-CG2 3.66Å; V47-M121 HydrophobicContact CG2-CG 4.18Å; V47-M121 HydrophobicContact CG2-SD 4.46Å
48	G	89.4	Confident	83	Confident	6 Å²	6	60.1 Å²	60.1	6%	0.062	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	166.5	170.6	0	0	0	0	0	113.2	Q120	G48-Q120 PolarHBondContact N-O 3.27Å; G48-Q120 PolarHBondContact O-N 3.24Å
49	Q	87.3	Confident	84.1	Confident	56 Å²	56	58.4 Å²	58.4	26%	0.262	29%	0.294	S	S	.	.			trans	62.7	47.6	-178.7	-53.8	-65	-13.6	0	0	113.3	G87 M115 H117 P118 Q120	Q49-G87 PolarHBondContact N-O 2.81Å; Q49-G87 VanDerWaalsContact N-O 3.14Å; Q49-M115 HydrophobicContact CB-SD 4.32Å; Q49-H117 HydrophobicContact CB-CB 4.47Å; Q49-H117 HydrophobicContact CG-CB 3.8Å; Q49-P118 WeakPolarHBondContact CB-O 3.42Å; Q49-P118 WeakPolarHBondContact CG-O 3.21Å; Q49-Q120 HydrophobicContact CG-CG 4.16Å
50	V	88	Confident	85.1	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.012	29%	0.291	C	S	.	.			trans	-95.5	137.7	169.7	176.1	0	0	0	0	109.3	V47 W54 L59 G87	V47-V50 HydrophobicContact CG1-CG2 3.7Å; V50-W54 HydrophobicContact CG1-CB 4.06Å; V50-L59 HydrophobicContact CG1-CD1 4.17Å; V50-L59 HydrophobicContact CG1-CD2 3.77Å; V50-L59 HydrophobicContact CG1-CG 4.36Å; V50-L59 HydrophobicContact CG2-CD2 4.06Å; V50-G87 PolarHBondContact N-O 2.58Å; V50-G87 CarbonylContact O-C 3.53Å; V50-G87 WeakPolarHBondContact O-CA 3.34Å
51	P	85.3	Confident	86.3	Confident	5 Å²	5	56 Å²	56	3%	0.032	27%	0.271	C	S	.	.			trans	-60	140.6	174.3	-22.1	32.1	0	0	0	111.9	T53 W54 L112 P113 M115	P51-T53 PolarHBondContact O-N 2.89Å; P51-T53 VanDerWaalsContact O-N 3.12Å; P51-W54 HydrophobicContact CB-CG 4.14Å; P51-W54 HydrophobicContact CG-CD2 4.32Å; P51-W54 HydrophobicContact CG-CG 4.16Å; P51-W54 PolarHBondContact O-N 3.43Å; P51-W54 VanDerWaalsContact O-N 3.11Å; P51-L112 VanDerWaalsContact CD-CD1 3.47Å; P51-L112 HydrophobicContact CG-CB 3.65Å; P51-L112 HydrophobicContact CG-CD1 4.29Å; P51-P113 WeakPolarHBondContact CG-O 3.46Å; P51-M115 HydrophobicContact CB-CG 4.48Å; P51-M115 HydrophobicContact CG-CG 3.84Å
52	R	84.1	Confident	87.2	Confident	148 Å²	148	53.3 Å²	53.3	56%	0.558	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.3	-178.7	-62	-169.9	-179.2	-173.7	5.3	114.3	S85	R52-S85 WeakPolarHBondContact CD-O 3.02Å; R52-S85 VanDerWaalsContact CG-O 3.3Å; R52-S85 WeakPolarHBondContact CG-O 3.43Å; R52-S85 PolarHBondContact NE-O 3.24Å
53	T	83.9	Confident	87.8	Confident	124 Å²	124	52 Å²	52	76%	0.761	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-16	175.7	46.2	0	0	0	0	113.6	P51	P51-T53 PolarHBondContact O-N 2.89Å; P51-T53 VanDerWaalsContact O-N 3.12Å
54	W	84.9	Confident	88.2	Confident	58 Å²	58	53.6 Å²	53.6	22%	0.22	25%	0.252	C	S	.	.			trans	-82.5	136.1	-176.7	-75.4	32	0	0	0	111.6	V50 P51 D58 L59 L62 L112 P113	V50-W54 HydrophobicContact CG1-CB 4.06Å; P51-W54 HydrophobicContact CB-CG 4.14Å; P51-W54 HydrophobicContact CG-CD2 4.32Å; P51-W54 HydrophobicContact CG-CG 4.16Å; P51-W54 PolarHBondContact O-N 3.43Å; P51-W54 VanDerWaalsContact O-N 3.11Å; W54-D58 HydrophobicContact CB-CB 4.45Å; W54-D58 HydrophobicContact CD2-CB 4.23Å; W54-D58 HydrophobicContact CE3-CB 4.1Å; W54-D58 HydrophobicContact CG-CB 4.4Å; W54-L59 HydrophobicContact CE3-CD2 3.91Å; W54-L59 HydrophobicContact CE3-CG 4.2Å; W54-L59 HydrophobicContact CZ3-CD2 4.48Å; W54-L62 HydrophobicContact CH2-CD2 4.34Å; W54-L62 HydrophobicContact CZ3-CB 4.13Å; W54-L62 HydrophobicContact CZ3-CD2 3.74Å; W54-L62 HydrophobicContact CZ3-CG 4.49Å; W54-L112 HydrophobicContact CE3-CD1 4.14Å; W54-L112 HydrophobicContact CH2-CD1 4.09Å; W54-L112 HydrophobicContact CH2-CD2 3.59Å; W54-L112 HydrophobicContact CH2-CG 4.39Å; W54-L112 HydrophobicContact CZ2-CD1 4.42Å; W54-L112 HydrophobicContact CZ2-CD2 4.02Å; W54-L112 HydrophobicContact CZ3-CD1 3.95Å; W54-L112 HydrophobicContact CZ3-CD2 4.17Å; W54-P113 HydrophobicContact CZ2-CG 4.35Å
55	S	87.4	Confident	88.3	Confident	45 Å²	45	59 Å²	59	32%	0.315	28%	0.277	S	S	.	.			trans	-96.2	174.5	177	75.1	0	0	0	0	112.2	K57 D58 L59	S55-K57 PolarHBondContact O-N 2.67Å; S55-K57 PolarHBondContact OG-N 2.89Å; S55-D58 WeakPolarHBondContact CA-OD2 3.3Å; S55-D58 VanDerWaalsContact CB-OD2 3.27Å; S55-D58 WeakPolarHBondContact CB-OD2 3.22Å; S55-D58 PolarHBondContact N-OD2 3.47Å; S55-D58 PolarHBondContact O-N 3.2Å; S55-D58 PolarHBondContact OG-OD2 3.41Å; S55-L59 WeakPolarHBondContact O-CD1 3.4Å; S55-L59 WeakPolarHBondContact O-CG 3.43Å; S55-L59 PolarHBondContact O-N 3.5Å
56	E	88.1	Confident	88.1	Confident	60 Å²	60	61.9 Å²	61.9	28%	0.28	29%	0.289	S	S	.	.	H	α-helix	trans	-57.4	-28.8	170.1	-79.6	116.7	-171.6	0	0	113.2	R60 I72 V74 R76	E56-R60 VanDerWaalsContact O-CB 3.32Å; E56-R60 WeakPolarHBondContact O-CB 3.4Å; E56-R60 PolarHBondContact O-N 2.89Å; E56-I72 HydrophobicContact CB-CB 4.41Å; E56-I72 HydrophobicContact CB-CG2 4.24Å; E56-I72 HydrophobicContact CG-CB 4.13Å; E56-I72 HydrophobicContact CG-CG2 3.77Å; E56-V74 HydrophobicContact CG-CB 4.35Å; E56-V74 HydrophobicContact CG-CG2 3.89Å; E56-V74 PolarHBondContact OE1-N 3.03Å; E56-R76 IonicContact OE1-CZ 3.41Å; E56-R76 IonicContact OE1-NH1 2.6Å; E56-R76 PolarHBondContact OE1-NH1 3.05Å; E56-R76 IonicContact OE1-NH2 2.84Å; E56-R76 PolarHBondContact OE1-NH2 3Å; E56-R76 IonicContact OE2-CZ 3.6Å; E56-R76 IonicContact OE2-NH1 2.67Å; E56-R76 IonicContact OE2-NH2 3.5Å; E56-R76 PolarHBondContact OE2-NH2 2.69Å
57	K	89.3	Confident	87.9	Confident	130 Å²	130	59.8 Å²	59.8	57%	0.565	29%	0.286	S	S	*	.	H	α-helix	trans	-71.6	-48.2	178.8	-175.5	178.5	178.8	-71.5	0	112	S55 L59 R60 E61	S55-K57 PolarHBondContact O-N 2.67Å; S55-K57 PolarHBondContact OG-N 2.89Å; K57-L59 VanDerWaalsContact C-N 3.26Å; K57-L59 PolarHBondContact O-N 3.27Å; K57-R60 WeakPolarHBondContact O-CB 3.5Å; K57-R60 PolarHBondContact O-N 3.33Å; K57-E61 WeakPolarHBondContact CE-OE1 3.36Å; K57-E61 IonicContact NZ-OE1 3.62Å; K57-E61 PolarHBondContact NZ-OE1 3.4Å; K57-E61 PolarHBondContact O-N 3.29Å
58	D	89.7	Confident	87.8	Confident	62 Å²	62	62.4 Å²	62.4	33%	0.332	31%	0.307	S	S	.	.	H	α-helix	trans	-65.2	-35.3	-179.1	-42.2	-67.5	0	0	0	111	W54 S55 L62	W54-D58 HydrophobicContact CB-CB 4.45Å; W54-D58 HydrophobicContact CD2-CB 4.23Å; W54-D58 HydrophobicContact CE3-CB 4.1Å; W54-D58 HydrophobicContact CG-CB 4.4Å; S55-D58 WeakPolarHBondContact CA-OD2 3.3Å; S55-D58 VanDerWaalsContact CB-OD2 3.27Å; S55-D58 WeakPolarHBondContact CB-OD2 3.22Å; S55-D58 PolarHBondContact N-OD2 3.47Å; S55-D58 PolarHBondContact O-N 3.2Å; S55-D58 PolarHBondContact OG-OD2 3.41Å; D58-L62 PolarHBondContact O-N 3.47Å; D58-L62 VanDerWaalsContact O-N 3.16Å
59	L	88.6	Confident	87.8	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-68.8	-39.1	171.8	-70.8	163.3	0	0	0	112.1	V50 W54 S55 K57 L62 F63 I72 V74 C89	V50-L59 HydrophobicContact CG1-CD1 4.17Å; V50-L59 HydrophobicContact CG1-CD2 3.77Å; V50-L59 HydrophobicContact CG1-CG 4.36Å; V50-L59 HydrophobicContact CG2-CD2 4.06Å; W54-L59 HydrophobicContact CE3-CD2 3.91Å; W54-L59 HydrophobicContact CE3-CG 4.2Å; W54-L59 HydrophobicContact CZ3-CD2 4.48Å; S55-L59 WeakPolarHBondContact O-CD1 3.4Å; S55-L59 WeakPolarHBondContact O-CG 3.43Å; S55-L59 PolarHBondContact O-N 3.5Å; K57-L59 VanDerWaalsContact C-N 3.26Å; K57-L59 PolarHBondContact O-N 3.27Å; L59-L62 PolarHBondContact O-N 3.26Å; L59-F63 HydrophobicContact CB-CD2 4.29Å; L59-F63 HydrophobicContact CB-CE2 4.22Å; L59-F63 HydrophobicContact CD2-CE2 3.93Å; L59-F63 WeakPolarHBondContact O-CD2 3.41Å; L59-F63 PolarHBondContact O-N 3.01Å; L59-I72 HydrophobicContact CB-CD1 3.97Å; L59-I72 HydrophobicContact CB-CG2 4.27Å; L59-I72 HydrophobicContact CD1-CG2 4.33Å; L59-V74 HydrophobicContact CD1-CG2 3.34Å; L59-C89 HydrophobicContact CD1-CB 4.12Å
60	R	89.9	Confident	87.7	Confident	112 Å²	112	63.8 Å²	63.8	42%	0.423	31%	0.309	S	S	.	.	H	α-helix	trans	-60	-50.2	175.4	-173.4	-179.7	175.6	130.5	12.2	110.6	E56 K57 L62 F63 E64 I72	E56-R60 VanDerWaalsContact O-CB 3.32Å; E56-R60 WeakPolarHBondContact O-CB 3.4Å; E56-R60 PolarHBondContact O-N 2.89Å; K57-R60 WeakPolarHBondContact O-CB 3.5Å; K57-R60 PolarHBondContact O-N 3.33Å; R60-L62 PolarHBondContact O-N 3.38Å; R60-F63 PolarHBondContact O-N 2.87Å; R60-F63 VanDerWaalsContact O-N 3.07Å; R60-E64 WeakPolarHBondContact CG-OE2 3.23Å; R60-E64 IonicContact CZ-OE1 3.21Å; R60-E64 IonicContact CZ-OE2 2.61Å; R60-E64 IonicContact NE-OE1 2.73Å; R60-E64 PolarHBondContact NE-OE1 3.19Å; R60-E64 IonicContact NE-OE2 2.93Å; R60-E64 PolarHBondContact NE-OE2 2.86Å; R60-E64 IonicContact NH2-OE1 3.38Å; R60-E64 PolarHBondContact NH2-OE1 3.08Å; R60-E64 IonicContact NH2-OE2 3.61Å; R60-E64 WeakPolarHBondContact O-CB 3.46Å; R60-E64 PolarHBondContact O-N 3.01Å; R60-I72 VanDerWaalsContact CA-CD1 3.43Å; R60-I72 HydrophobicContact CB-CD1 3.84Å; R60-I72 VanDerWaalsContact N-CD1 3.33Å
61	E	89.1	Confident	87.5	Confident	115 Å²	115	66.4 Å²	66.4	54%	0.537	32%	0.321	S	S	.	.	H	α-helix	trans	-59.5	-34.3	177.6	-71.3	171.6	-156.7	0	0	112.6	K57	K57-E61 WeakPolarHBondContact CE-OE1 3.36Å; K57-E61 IonicContact NZ-OE1 3.62Å; K57-E61 PolarHBondContact NZ-OE1 3.4Å; K57-E61 PolarHBondContact O-N 3.29Å
62	L	88.1	Confident	87.8	Confident	16 Å²	16	67.5 Å²	67.5	8%	0.084	33%	0.326	C	S	.	.	H	α-helix	trans	-68.5	-42.1	172.3	174	63.8	0	0	0	113.4	W54 D58 L59 R60 Y66 L106 K110 L112 I119	W54-L62 HydrophobicContact CH2-CD2 4.34Å; W54-L62 HydrophobicContact CZ3-CB 4.13Å; W54-L62 HydrophobicContact CZ3-CD2 3.74Å; W54-L62 HydrophobicContact CZ3-CG 4.49Å; D58-L62 PolarHBondContact O-N 3.47Å; D58-L62 VanDerWaalsContact O-N 3.16Å; L59-L62 PolarHBondContact O-N 3.26Å; R60-L62 PolarHBondContact O-N 3.38Å; L62-Y66 WeakPolarHBondContact O-CD2 3.3Å; L62-Y66 WeakPolarHBondContact O-CE2 3.39Å; L62-L106 HydrophobicContact CD1-CD2 4.32Å; L62-K110 HydrophobicContact CD1-CD 4.06Å; L62-L112 HydrophobicContact CD2-CD1 4.33Å; L62-L112 HydrophobicContact CD2-CD2 4.26Å; L62-I119 HydrophobicContact CD2-CD1 4.01Å
63	F	88.9	Confident	88	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-85.9	-32.7	-173.6	-72.6	-58.1	0	0	0	113.8	V47 L59 R60 Q65 Y66 G67 V69 I72 V91 F93 L106 M121	V47-F63 HydrophobicContact CB-CZ 4.29Å; V47-F63 HydrophobicContact CG1-CZ 3.83Å; V47-F63 HydrophobicContact CG2-CE1 4.26Å; V47-F63 HydrophobicContact CG2-CE2 4.31Å; V47-F63 HydrophobicContact CG2-CZ 3.64Å; L59-F63 HydrophobicContact CB-CD2 4.29Å; L59-F63 HydrophobicContact CB-CE2 4.22Å; L59-F63 HydrophobicContact CD2-CE2 3.93Å; L59-F63 WeakPolarHBondContact O-CD2 3.41Å; L59-F63 PolarHBondContact O-N 3.01Å; R60-F63 PolarHBondContact O-N 2.87Å; R60-F63 VanDerWaalsContact O-N 3.07Å; F63-Q65 PolarHBondContact O-N 2.88Å; F63-Y66 PolarHBondContact O-N 3.19Å; F63-G67 PolarHBondContact O-N 3.31Å; F63-V69 HydrophobicContact CB-CG2 3.74Å; F63-I72 HydrophobicContact CD2-CD1 4.04Å; F63-V91 HydrophobicContact CB-CG2 4.44Å; F63-V91 HydrophobicContact CD2-CB 4.29Å; F63-V91 HydrophobicContact CD2-CG1 4.37Å; F63-V91 HydrophobicContact CD2-CG2 4.08Å; F63-V91 HydrophobicContact CE1-CG1 4.43Å; F63-V91 HydrophobicContact CE2-CB 4.4Å; F63-V91 HydrophobicContact CE2-CG1 4.23Å; F63-V91 HydrophobicContact CG-CG2 4.24Å; F63-V91 HydrophobicContact CZ-CG1 4.29Å; F63-F93 HydrophobicContact CB-CE1 4.17Å; F63-F93 HydrophobicContact CB-CZ 3.87Å; F63-F93 AromaticContact CD1-CZ 3.93Å; F63-F93 HydrophobicContact CD1-CZ 3.93Å; F63-F93 HydrophobicContact CG-CZ 4.13Å; F63-L106 HydrophobicContact CD1-CD1 3.73Å; F63-L106 HydrophobicContact CE1-CD1 3.4Å; F63-L106 HydrophobicContact CZ-CD1 4.47Å; F63-M121 HydrophobicContact CE1-CE 4.47Å; F63-M121 HydrophobicContact CE1-SD 3.99Å
64	E	89.7	Confident	88.3	Confident	80 Å²	80	58.2 Å²	58.2	37%	0.374	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-21.4	-178.3	-162.1	146.6	-132.6	0	0	111.9	R60 Y66 G67 V69	R60-E64 WeakPolarHBondContact CG-OE2 3.23Å; R60-E64 IonicContact CZ-OE1 3.21Å; R60-E64 IonicContact CZ-OE2 2.61Å; R60-E64 IonicContact NE-OE1 2.73Å; R60-E64 PolarHBondContact NE-OE1 3.19Å; R60-E64 IonicContact NE-OE2 2.93Å; R60-E64 PolarHBondContact NE-OE2 2.86Å; R60-E64 IonicContact NH2-OE1 3.38Å; R60-E64 PolarHBondContact NH2-OE1 3.08Å; R60-E64 IonicContact NH2-OE2 3.61Å; R60-E64 WeakPolarHBondContact O-CB 3.46Å; R60-E64 PolarHBondContact O-N 3.01Å; E64-Y66 PolarHBondContact O-N 2.9Å; E64-G67 WeakPolarHBondContact CA-O 3.35Å; E64-G67 PolarHBondContact O-N 2.89Å; E64-V69 HydrophobicContact CB-CG2 4.5Å
65	Q	88.6	Confident	88.3	Confident	153 Å²	153	58.4 Å²	58.4	72%	0.715	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.2	167.5	-178.3	59.7	94.5	0	0	114.2	F63	F63-Q65 PolarHBondContact O-N 2.88Å
66	Y	87.9	Confident	88.3	Confident	62 Å²	62	61.5 Å²	61.5	24%	0.243	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-8.9	179.4	-57.4	-80.9	0	0	0	113.1	L62 F63 E64 A102 A105 L106	L62-Y66 WeakPolarHBondContact O-CD2 3.3Å; L62-Y66 WeakPolarHBondContact O-CE2 3.39Å; F63-Y66 PolarHBondContact O-N 3.19Å; E64-Y66 PolarHBondContact O-N 2.9Å; Y66-A102 HydrophobicContact CD2-CB 4.3Å; Y66-A102 HydrophobicContact CG-CB 4Å; Y66-A105 HydrophobicContact CD1-CB 3.98Å; Y66-A105 HydrophobicContact CE1-CB 3.33Å; Y66-L106 HydrophobicContact CD2-CD1 4.16Å; Y66-L106 HydrophobicContact CE2-CD1 3.8Å; Y66-L106 HydrophobicContact CE2-CD2 3.88Å; Y66-L106 HydrophobicContact CE2-CG 3.95Å; Y66-L106 WeakPolarHBondContact OH-CD2 3.18Å
67	G	87.3	Confident	88	Confident	21 Å²	21	59.4 Å²	59.4	22%	0.216	28%	0.284	C	S	.	.	S	Bend	trans	147.3	164.3	175.1	0	0	0	0	0	112.8	F63 E64 V69	F63-G67 PolarHBondContact O-N 3.31Å; E64-G67 WeakPolarHBondContact CA-O 3.35Å; E64-G67 PolarHBondContact O-N 2.89Å; G67-V69 PolarHBondContact O-N 3.41Å
68	A	88.2	Confident	87.4	Confident	54 Å²	54	64.5 Å²	64.5	45%	0.446	30%	0.299	S	S	.	.			trans	-58	129.6	-173.5	0	0	0	0	0	112.7	Y94	A68-Y94 HydrophobicContact CB-CD2 3.68Å; A68-Y94 HydrophobicContact CB-CE2 4.35Å; A68-Y94 HydrophobicContact CB-CG 4.42Å; A68-Y94 PolarHBondContact O-N 3.07Å
69	V	89.1	Confident	86.5	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.018	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.5	-179.6	-178	0	0	0	0	110.2	F63 E64 G67 I72 V91 F93 Y94	F63-V69 HydrophobicContact CB-CG2 3.74Å; E64-V69 HydrophobicContact CB-CG2 4.5Å; G67-V69 PolarHBondContact O-N 3.41Å; V69-I72 HydrophobicContact CG1-CD1 4.03Å; V69-I72 HydrophobicContact CG1-CG1 3.61Å; V69-V91 HydrophobicContact CG1-CG2 3.66Å; V69-V91 HydrophobicContact CG2-CG2 4.33Å; V69-F93 HydrophobicContact CG2-CD1 4.06Å; V69-F93 HydrophobicContact CG2-CE1 3.82Å; V69-F93 HydrophobicContact CG2-CZ 4.44Å; V69-Y94 WeakPolarHBondContact O-CE2 3.3Å
70	Y	85.6	Confident	85.8	Confident	88 Å²	88	67 Å²	67	35%	0.345	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-53.4	176.7	179.2	-113.7	0	0	0	111.6	D36 P38 T92 Y94	D36-Y70 WeakPolarHBondContact O-CE2 3.45Å; D36-Y70 PolarHBondContact O-OH 3.39Å; P38-Y70 HydrophobicContact CB-CD1 4.27Å; P38-Y70 HydrophobicContact CB-CG 4.22Å; P38-Y70 HydrophobicContact CG-CD1 4.09Å; P38-Y70 HydrophobicContact CG-CE1 3.98Å; P38-Y70 HydrophobicContact CG-CG 4.45Å; Y70-T92 WeakPolarHBondContact CB-O 3.44Å; Y70-T92 HydrophobicContact CD1-CG2 4.26Å; Y70-T92 PolarHBondContact N-O 2.88Å; Y70-Y94 HydrophobicContact CD2-CD1 4.44Å; Y70-Y94 AromaticContact CD2-CE1 3.74Å; Y70-Y94 HydrophobicContact CD2-CE1 3.74Å; Y70-Y94 HydrophobicContact CD2-CE2 4.24Å; Y70-Y94 AromaticContact CD2-CZ 3.64Å; Y70-Y94 HydrophobicContact CE2-CE1 4.49Å
71	E	84.8	Confident	84.6	Confident	58 Å²	58	69.1 Å²	69.1	27%	0.271	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.7	-175.8	-173.5	-156.1	166.6	0	0	110	K44 N73 V91 T92	K44-E71 WeakPolarHBondContact CE-OE2 3.35Å; K44-E71 IonicContact NZ-OE1 2.81Å; K44-E71 PolarHBondContact NZ-OE1 2.98Å; K44-E71 IonicContact NZ-OE2 2.9Å; K44-E71 PolarHBondContact NZ-OE2 3.28Å; E71-N73 PolarHBondContact OE1-ND2 2.94Å; E71-V91 CarbonylContact O-C 3.57Å; E71-V91 WeakPolarHBondContact O-CA 3.48Å; E71-T92 PolarHBondContact N-O 2.8Å; E71-T92 PolarHBondContact O-N 3.36Å; E71-T92 PolarHBondContact OE2-OG1 2.94Å
72	I	90.6	Very high	83.7	Confident	28 Å²	28	69 Å²	69	14%	0.144	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.1	158.8	-59.4	-173.7	0	0	0	108.1	E56 L59 R60 F63 V69 V74 C89 F90 V91	E56-I72 HydrophobicContact CB-CB 4.41Å; E56-I72 HydrophobicContact CB-CG2 4.24Å; E56-I72 HydrophobicContact CG-CB 4.13Å; E56-I72 HydrophobicContact CG-CG2 3.77Å; L59-I72 HydrophobicContact CB-CD1 3.97Å; L59-I72 HydrophobicContact CB-CG2 4.27Å; L59-I72 HydrophobicContact CD1-CG2 4.33Å; R60-I72 VanDerWaalsContact CA-CD1 3.43Å; R60-I72 HydrophobicContact CB-CD1 3.84Å; R60-I72 VanDerWaalsContact N-CD1 3.33Å; F63-I72 HydrophobicContact CD2-CD1 4.04Å; V69-I72 HydrophobicContact CG1-CD1 4.03Å; V69-I72 HydrophobicContact CG1-CG1 3.61Å; I72-V74 HydrophobicContact CG2-CG2 4.46Å; I72-C89 HydrophobicContact CG2-CB 4.42Å; I72-F90 WeakPolarHBondContact CA-O 3.16Å; I72-V91 HydrophobicContact CD1-CG2 4.33Å; I72-V91 HydrophobicContact CG1-CB 4.28Å; I72-V91 HydrophobicContact CG1-CG2 3.94Å
73	N	88.4	Confident	83	Confident	72 Å²	72	71.3 Å²	71.3	39%	0.385	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	102.6	-179.4	-166	-39	0	0	0	109	E71 C89 F90	E71-N73 PolarHBondContact OE1-ND2 2.94Å; N73-C89 CarbonylContact O-C 3.56Å; N73-C89 VanDerWaalsContact O-CA 3.3Å; N73-C89 WeakPolarHBondContact O-CA 3.45Å; N73-C89 WeakPolarHBondContact O-CB 3.36Å; N73-F90 PolarHBondContact N-O 3.37Å; N73-F90 PolarHBondContact O-N 3.21Å
74	V	89.5	Confident	82.5	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.024	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	122.5	179.7	169	0	0	0	0	110	E56 L59 I72 R76 C89	E56-V74 HydrophobicContact CG-CB 4.35Å; E56-V74 HydrophobicContact CG-CG2 3.89Å; E56-V74 PolarHBondContact OE1-N 3.03Å; L59-V74 HydrophobicContact CD1-CG2 3.34Å; I72-V74 HydrophobicContact CG2-CG2 4.46Å; V74-R76 HydrophobicContact CG1-CG 4.16Å; V74-R76 PolarHBondContact O-N 3.25Å; V74-R76 PolarHBondContact O-NH1 2.74Å; V74-C89 HydrophobicContact CB-CB 4.39Å; V74-C89 HydrophobicContact CG2-CB 3.81Å
75	L	85.6	Confident	82.2	Confident	63 Å²	63	71.8 Å²	71.8	33%	0.33	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	112.8	177.5	-101.4	60.9	0	0	0	109.7	K86 C88 F90	L75-K86 HydrophobicContact CB-CB 4.37Å; L75-K86 HydrophobicContact CB-CG 4.48Å; L75-K86 WeakPolarHBondContact O-CB 3.47Å; L75-K86 PolarHBondContact O-N 3.34Å; L75-C88 PolarHBondContact N-O 3.41Å; L75-C88 VanDerWaalsContact N-O 3.09Å; L75-F90 HydrophobicContact CD1-CD2 3.58Å; L75-F90 HydrophobicContact CD1-CE2 3.58Å; L75-F90 HydrophobicContact CD2-CE2 4.1Å
76	R	87	Confident	81.9	Confident	109 Å²	109	68.8 Å²	68.8	41%	0.411	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	146.9	178.9	-62.7	169.9	-176.2	92.5	-18	110.6	E56 V74 R78 P83 Q84	E56-R76 IonicContact OE1-CZ 3.41Å; E56-R76 IonicContact OE1-NH1 2.6Å; E56-R76 PolarHBondContact OE1-NH1 3.05Å; E56-R76 IonicContact OE1-NH2 2.84Å; E56-R76 PolarHBondContact OE1-NH2 3Å; E56-R76 IonicContact OE2-CZ 3.6Å; E56-R76 IonicContact OE2-NH1 2.67Å; E56-R76 IonicContact OE2-NH2 3.5Å; E56-R76 PolarHBondContact OE2-NH2 2.69Å; V74-R76 HydrophobicContact CG1-CG 4.16Å; V74-R76 PolarHBondContact O-N 3.25Å; V74-R76 PolarHBondContact O-NH1 2.74Å; R76-R78 PolarHBondContact O-N 3.09Å; R76-P83 HydrophobicContact CB-CB 3.87Å; R76-Q84 CarbonylContact C-O 3.58Å; R76-Q84 WeakPolarHBondContact CA-O 3.41Å
77	D	81.3	Confident	81.8	Confident	17 Å²	17	66.3 Å²	66.3	9%	0.091	34%	0.34	C	S	.	.			trans	-77.3	104.1	175.9	-154.8	11.7	0	0	0	110.2	S79 Q80 Q84 K86 K512	D77-S79 PolarHBondContact O-N 2.98Å; D77-S79 VanDerWaalsContact O-N 3.08Å; D77-Q80 HydrophobicContact CB-CG 4.45Å; D77-Q80 PolarHBondContact O-N 3.26Å; D77-Q80 VanDerWaalsContact O-N 3.17Å; D77-Q80 PolarHBondContact OD2-NE2 2.82Å; D77-Q84 PolarHBondContact N-O 2.85Å; D77-K86 HydrophobicContact CB-CD 4.26Å; D77-K86 WeakPolarHBondContact OD1-CE 3.39Å; D77-K86 IonicContact OD1-NZ 2.71Å; D77-K86 PolarHBondContact OD1-NZ 3.26Å; D77-K86 IonicContact OD2-NZ 3.71Å; D77-K86 PolarHBondContact OD2-NZ 3.25Å; D77-K512 IonicContact OD1-NZ 3.31Å; D77-K512 PolarHBondContact OD1-NZ 3.4Å; D77-K512 IonicContact OD2-NZ 3.44Å
78	R	78	Confident	81.9	Confident	236 Å²	236	66.2 Å²	66.2	89%	0.891	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.7	-178.8	-169.6	168.6	178.8	174.5	1.6	114.2	R76	R76-R78 PolarHBondContact O-N 3.09Å
79	S	71.3	Confident	82	Confident	46 Å²	46	63.6 Å²	63.6	32%	0.322	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	17.8	175.2	76.7	0	0	0	0	113.8	D77 K512	D77-S79 PolarHBondContact O-N 2.98Å; D77-S79 VanDerWaalsContact O-N 3.08Å; S79-K512 VanDerWaalsContact OG-CD 3.24Å; S79-K512 WeakPolarHBondContact OG-CD 3.26Å; S79-K512 WeakPolarHBondContact OG-CE 2.91Å; S79-K512 PolarHBondContact OG-NZ 3.08Å
80	Q	72.9	Confident	82.1	Confident	69 Å²	69	65.2 Å²	65.2	32%	0.322	32%	0.321	S	S	.	.	S	Bend	trans	-123.5	139.8	169.1	-67.7	-179.9	56.3	0	0	107	D77 P82 P83	D77-Q80 HydrophobicContact CB-CG 4.45Å; D77-Q80 PolarHBondContact O-N 3.26Å; D77-Q80 VanDerWaalsContact O-N 3.17Å; D77-Q80 PolarHBondContact OD2-NE2 2.82Å; Q80-P82 CarbonylContact C-O 3.54Å; Q80-P82 CarbonylContact O-C 3.51Å; Q80-P83 VanDerWaalsContact O-CA 3.23Å; Q80-P83 WeakPolarHBondContact O-CA 3.29Å; Q80-P83 VanDerWaalsContact O-N 3.12Å
81	N	64.9	Low	82.4	Confident	158 Å²	158	61 Å²	61	85%	0.845	31%	0.305	S	S	*	.	S	Bend	trans	-116.4	114.8	173.3	-91.7	-58.6	0	0	0	108.8
82	P	70.9	Confident	82.6	Confident	113 Å²	113	58.8 Å²	58.8	73%	0.734	30%	0.295	S	S	*	.	S	Bend	cis	-69.9	157.6	-3.2	30.4	-36.1	0	0	0	113.5	Q80 Q84	Q80-P82 CarbonylContact C-O 3.54Å; Q80-P82 CarbonylContact O-C 3.51Å; P82-Q84 PolarHBondContact O-N 3.45Å
83	P	73.3	Confident	82.5	Confident	64 Å²	64	57.5 Å²	57.5	42%	0.416	29%	0.289	S	S	.	.			trans	-62.9	98.7	-177.8	-26.4	36.7	0	0	0	114	R76 Q80	R76-P83 HydrophobicContact CB-CB 3.87Å; Q80-P83 VanDerWaalsContact O-CA 3.23Å; Q80-P83 WeakPolarHBondContact O-CA 3.29Å; Q80-P83 VanDerWaalsContact O-N 3.12Å
84	Q	77.6	Confident	82.5	Confident	80 Å²	80	57.5 Å²	57.5	37%	0.374	28%	0.284	S	S	.	.			trans	-71.4	133.5	-175.7	-167.6	-178.4	95.5	0	0	112	R76 D77 P82 K86	R76-Q84 CarbonylContact C-O 3.58Å; R76-Q84 WeakPolarHBondContact CA-O 3.41Å; D77-Q84 PolarHBondContact N-O 2.85Å; P82-Q84 PolarHBondContact O-N 3.45Å; Q84-K86 PolarHBondContact O-N 3.15Å
85	S	84.3	Confident	82.3	Confident	9 Å²	9	60.1 Å²	60.1	6%	0.063	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	137.1	174.1	172.8	0	0	0	0	111.8	R52 G87	R52-S85 WeakPolarHBondContact CD-O 3.02Å; R52-S85 VanDerWaalsContact CG-O 3.3Å; R52-S85 WeakPolarHBondContact CG-O 3.43Å; R52-S85 PolarHBondContact NE-O 3.24Å; S85-G87 PolarHBondContact O-N 3.16Å; S85-G87 PolarHBondContact OG-N 3.25Å; S85-G87 VanDerWaalsContact OG-N 3.16Å
86	K	81.7	Confident	82.3	Confident	91 Å²	91	62.2 Å²	62.2	40%	0.396	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-10.2	174	-71.2	-65.1	-172.6	-174.3	0	113.1	L75 D77 Q84	L75-K86 HydrophobicContact CB-CB 4.37Å; L75-K86 HydrophobicContact CB-CG 4.48Å; L75-K86 WeakPolarHBondContact O-CB 3.47Å; L75-K86 PolarHBondContact O-N 3.34Å; D77-K86 HydrophobicContact CB-CD 4.26Å; D77-K86 WeakPolarHBondContact OD1-CE 3.39Å; D77-K86 IonicContact OD1-NZ 2.71Å; D77-K86 PolarHBondContact OD1-NZ 3.26Å; D77-K86 IonicContact OD2-NZ 3.71Å; D77-K86 PolarHBondContact OD2-NZ 3.25Å; Q84-K86 PolarHBondContact O-N 3.15Å
87	G	85.6	Confident	82.3	Confident	10 Å²	10	63.4 Å²	63.4	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81	28.7	-171.4	0	0	0	0	0	113.5	Q49 V50 S85	Q49-G87 PolarHBondContact N-O 2.81Å; Q49-G87 VanDerWaalsContact N-O 3.14Å; V50-G87 PolarHBondContact N-O 2.58Å; V50-G87 CarbonylContact O-C 3.53Å; V50-G87 WeakPolarHBondContact O-CA 3.34Å; S85-G87 PolarHBondContact O-N 3.16Å; S85-G87 PolarHBondContact OG-N 3.25Å; S85-G87 VanDerWaalsContact OG-N 3.16Å
88	C	88.9	Confident	82.7	Confident	18 Å²	18	62.8 Å²	62.8	12%	0.122	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157.2	172.5	58	0	0	0	0	111.7	F46 V47 L75	F46-C88 HydrophobicContact CE2-CB 3.64Å; F46-C88 HydrophobicContact CZ-CB 3.64Å; V47-C88 CarbonylContact O-C 3.38Å; V47-C88 WeakPolarHBondContact O-CA 3.45Å; V47-C88 WeakPolarHBondContact O-CB 3.21Å; L75-C88 PolarHBondContact N-O 3.41Å; L75-C88 VanDerWaalsContact N-O 3.09Å
89	C	90.5	Very high	83.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	169.2	173	64.2	0	0	0	0	111.2	V47 L59 I72 N73 V74	V47-C89 PolarHBondContact N-O 2.97Å; V47-C89 PolarHBondContact O-N 3.38Å; L59-C89 HydrophobicContact CD1-CB 4.12Å; I72-C89 HydrophobicContact CG2-CB 4.42Å; N73-C89 CarbonylContact O-C 3.56Å; N73-C89 VanDerWaalsContact O-CA 3.3Å; N73-C89 WeakPolarHBondContact O-CA 3.45Å; N73-C89 WeakPolarHBondContact O-CB 3.36Å; V74-C89 HydrophobicContact CB-CB 4.39Å; V74-C89 HydrophobicContact CG2-CB 3.81Å
90	F	91.9	Very high	84.1	Confident	36 Å²	36	53.4 Å²	53.4	16%	0.158	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	143.9	157.5	-64.6	-78.9	0	0	0	109.4	K44 M45 F46 I72 N73 L75 A124	K44-F90 HydrophobicContact CG-CB 4.19Å; K44-F90 HydrophobicContact CG-CD1 4.41Å; M45-F90 CarbonylContact O-C 3.43Å; M45-F90 VanDerWaalsContact O-CA 3.29Å; M45-F90 WeakPolarHBondContact O-CA 3.36Å; F46-F90 HydrophobicContact CB-CD1 4.06Å; F46-F90 HydrophobicContact CB-CE1 3.83Å; F46-F90 HydrophobicContact CD2-CD1 4.21Å; F46-F90 AromaticContact CD2-CE1 3.71Å; F46-F90 HydrophobicContact CD2-CE1 3.71Å; F46-F90 AromaticContact CD2-CZ 3.96Å; F46-F90 HydrophobicContact CD2-CZ 3.96Å; F46-F90 HydrophobicContact CG-CE1 4.25Å; I72-F90 WeakPolarHBondContact CA-O 3.16Å; N73-F90 PolarHBondContact N-O 3.37Å; N73-F90 PolarHBondContact O-N 3.21Å; L75-F90 HydrophobicContact CD1-CD2 3.58Å; L75-F90 HydrophobicContact CD1-CE2 3.58Å; L75-F90 HydrophobicContact CD2-CE2 4.1Å; F90-A124 HydrophobicContact CD1-CB 3.8Å; F90-A124 HydrophobicContact CE1-CB 3.68Å
91	V	91.2	Very high	85	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.2	172	57	0	0	0	0	109.3	M45 V47 F63 V69 E71 I72 F93 M121	M45-V91 HydrophobicContact CB-CG1 3.99Å; M45-V91 PolarHBondContact N-O 3.25Å; M45-V91 PolarHBondContact O-N 3.15Å; V47-V91 HydrophobicContact CG2-CG1 3.69Å; F63-V91 HydrophobicContact CB-CG2 4.44Å; F63-V91 HydrophobicContact CD2-CB 4.29Å; F63-V91 HydrophobicContact CD2-CG1 4.37Å; F63-V91 HydrophobicContact CD2-CG2 4.08Å; F63-V91 HydrophobicContact CE1-CG1 4.43Å; F63-V91 HydrophobicContact CE2-CB 4.4Å; F63-V91 HydrophobicContact CE2-CG1 4.23Å; F63-V91 HydrophobicContact CG-CG2 4.24Å; F63-V91 HydrophobicContact CZ-CG1 4.29Å; V69-V91 HydrophobicContact CG1-CG2 3.66Å; V69-V91 HydrophobicContact CG2-CG2 4.33Å; E71-V91 CarbonylContact O-C 3.57Å; E71-V91 WeakPolarHBondContact O-CA 3.48Å; I72-V91 HydrophobicContact CD1-CG2 4.33Å; I72-V91 HydrophobicContact CG1-CB 4.28Å; I72-V91 HydrophobicContact CG1-CG2 3.94Å; V91-F93 HydrophobicContact CB-CE2 4.44Å; V91-F93 HydrophobicContact CG1-CE2 3.83Å; V91-F93 HydrophobicContact CG2-CD2 4.14Å; V91-F93 HydrophobicContact CG2-CE2 3.72Å; V91-F93 HydrophobicContact CG2-CZ 4.08Å; V91-M121 HydrophobicContact CG1-CE 4.29Å
92	T	88.8	Confident	86.2	Confident	12 Å²	12	46.9 Å²	46.9	7%	0.074	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.4	176.7	-46.3	0	0	0	0	107.5	K44 Y70 E71	K44-T92 WeakPolarHBondContact CG-OG1 3.44Å; Y70-T92 WeakPolarHBondContact CB-O 3.44Å; Y70-T92 HydrophobicContact CD1-CG2 4.26Å; Y70-T92 PolarHBondContact N-O 2.88Å; E71-T92 PolarHBondContact N-O 2.8Å; E71-T92 PolarHBondContact O-N 3.36Å; E71-T92 PolarHBondContact OE2-OG1 2.94Å
93	F	89.6	Confident	87.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	153.6	175.7	-69.8	-95.8	0	0	0	110.5	A42 F63 V69 V91 T95 A98 A99 A102 M121	A42-F93 WeakPolarHBondContact CB-O 3.26Å; F63-F93 HydrophobicContact CB-CE1 4.17Å; F63-F93 HydrophobicContact CB-CZ 3.87Å; F63-F93 AromaticContact CD1-CZ 3.93Å; F63-F93 HydrophobicContact CD1-CZ 3.93Å; F63-F93 HydrophobicContact CG-CZ 4.13Å; V69-F93 HydrophobicContact CG2-CD1 4.06Å; V69-F93 HydrophobicContact CG2-CE1 3.82Å; V69-F93 HydrophobicContact CG2-CZ 4.44Å; V91-F93 HydrophobicContact CB-CE2 4.44Å; V91-F93 HydrophobicContact CG1-CE2 3.83Å; V91-F93 HydrophobicContact CG2-CD2 4.14Å; V91-F93 HydrophobicContact CG2-CE2 3.72Å; V91-F93 HydrophobicContact CG2-CZ 4.08Å; F93-T95 WeakPolarHBondContact CB-O 3.03Å; F93-T95 PolarHBondContact O-N 3.27Å; F93-A98 HydrophobicContact CB-CB 4.24Å; F93-A98 HydrophobicContact CD1-CB 3.75Å; F93-A98 HydrophobicContact CE1-CB 4.43Å; F93-A98 HydrophobicContact CG-CB 4.19Å; F93-A99 HydrophobicContact CB-CB 4.22Å; F93-A99 HydrophobicContact CD2-CB 3.67Å; F93-A99 HydrophobicContact CE2-CB 4.37Å; F93-A99 HydrophobicContact CG-CB 4.16Å; F93-A102 HydrophobicContact CE1-CB 4.32Å; F93-A102 HydrophobicContact CE2-CB 4.19Å; F93-A102 HydrophobicContact CZ-CB 3.66Å; F93-M121 HydrophobicContact CE2-CE 3.68Å; F93-M121 HydrophobicContact CZ-CE 4.27Å
94	Y	87.1	Confident	87.9	Confident	72 Å²	72	46.9 Å²	46.9	28%	0.282	23%	0.226	S	C	.	.	S	Bend	trans	-63.4	-24	173.4	-79.5	-89.1	0	0	0	113	P35 D39 A68 V69 Y70	P35-Y94 WeakPolarHBondContact O-CE1 3.31Å; P35-Y94 PolarHBondContact O-OH 2.97Å; D39-Y94 WeakPolarHBondContact CB-O 3.4Å; D39-Y94 PolarHBondContact N-O 2.81Å; A68-Y94 HydrophobicContact CB-CD2 3.68Å; A68-Y94 HydrophobicContact CB-CE2 4.35Å; A68-Y94 HydrophobicContact CB-CG 4.42Å; A68-Y94 PolarHBondContact O-N 3.07Å; V69-Y94 WeakPolarHBondContact O-CE2 3.3Å; Y70-Y94 HydrophobicContact CD2-CD1 4.44Å; Y70-Y94 AromaticContact CD2-CE1 3.74Å; Y70-Y94 HydrophobicContact CD2-CE1 3.74Å; Y70-Y94 HydrophobicContact CD2-CE2 4.24Å; Y70-Y94 AromaticContact CD2-CZ 3.64Å; Y70-Y94 HydrophobicContact CE2-CE1 4.49Å
95	T	85.9	Confident	88.4	Confident	60 Å²	60	44.9 Å²	44.9	37%	0.368	22%	0.223	S	C	.	.	S	Bend	trans	-134.2	148.6	177.9	68.5	0	0	0	0	112	F93 K97 A98 A99	F93-T95 WeakPolarHBondContact CB-O 3.03Å; F93-T95 PolarHBondContact O-N 3.27Å; T95-K97 VanDerWaalsContact C-N 3.27Å; T95-K97 PolarHBondContact O-N 3.26Å; T95-A98 PolarHBondContact OG1-N 2.75Å; T95-A99 PolarHBondContact O-N 2.96Å
96	R	84.8	Confident	88.6	Confident	106 Å²	106	44.4 Å²	44.4	40%	0.4	22%	0.22	S	C	.	.	H	α-helix	trans	-60.2	-35.8	172.5	-170	170.9	176.4	174.8	-8.4	113.4	D41 I43 A99 L100	D41-R96 WeakPolarHBondContact O-CB 3.45Å; D41-R96 VanDerWaalsContact OD1-CD 3.3Å; D41-R96 WeakPolarHBondContact OD1-CD 3.48Å; D41-R96 IonicContact OD1-CZ 2.69Å; D41-R96 IonicContact OD1-NE 2.7Å; D41-R96 IonicContact OD1-NH1 3.66Å; D41-R96 PolarHBondContact OD1-NH1 3.41Å; D41-R96 VanDerWaalsContact OD2-CB 3.29Å; D41-R96 WeakPolarHBondContact OD2-CB 3.21Å; D41-R96 WeakPolarHBondContact OD2-CD 3.27Å; D41-R96 IonicContact OD2-NH1 2.62Å; I43-R96 HydrophobicContact CD1-CG 3.77Å; I43-R96 HydrophobicContact CG1-CG 4.08Å; R96-A99 WeakPolarHBondContact O-CB 3.02Å; R96-A99 PolarHBondContact O-N 2.86Å; R96-L100 HydrophobicContact CG-CD1 3.96Å; R96-L100 HydrophobicContact CG-CG 4.28Å; R96-L100 WeakPolarHBondContact O-CG 3.42Å; R96-L100 PolarHBondContact O-N 2.71Å
97	K	87.7	Confident	88.9	Confident	134 Å²	134	42.5 Å²	42.5	58%	0.583	21%	0.212	S	C	*	.	H	α-helix	trans	-59.3	-50.1	-177.9	-167.1	-173.2	169.7	-80.5	0	110.5	T95 A99 L100 E101	T95-K97 VanDerWaalsContact C-N 3.27Å; T95-K97 PolarHBondContact O-N 3.26Å; K97-A99 VanDerWaalsContact C-N 3.34Å; K97-A99 PolarHBondContact O-N 3.16Å; K97-L100 PolarHBondContact O-N 2.98Å; K97-E101 WeakPolarHBondContact CG-OE2 3.1Å; K97-E101 IonicContact NZ-OE1 2.67Å; K97-E101 PolarHBondContact NZ-OE1 3.18Å; K97-E101 IonicContact NZ-OE2 2.69Å; K97-E101 PolarHBondContact NZ-OE2 2.6Å; K97-E101 WeakPolarHBondContact O-CG 3.43Å; K97-E101 PolarHBondContact O-N 3.37Å
98	A	89.6	Confident	88.8	Confident	5 Å²	5	46.4 Å²	46.4	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-59.4	-42.1	175.1	0	0	0	0	0	112.5	F93 T95 L100 E101 A102	F93-A98 HydrophobicContact CB-CB 4.24Å; F93-A98 HydrophobicContact CD1-CB 3.75Å; F93-A98 HydrophobicContact CE1-CB 4.43Å; F93-A98 HydrophobicContact CG-CB 4.19Å; T95-A98 PolarHBondContact OG1-N 2.75Å; A98-L100 VanDerWaalsContact C-N 3.33Å; A98-L100 PolarHBondContact O-N 2.96Å; A98-E101 PolarHBondContact O-N 2.68Å; A98-A102 WeakPolarHBondContact O-CB 3.44Å; A98-A102 PolarHBondContact O-N 2.81Å
99	A	89.5	Confident	88.4	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-38.6	176.9	0	0	0	0	0	113	M45 F93 T95 R96 K97 Q103	M45-A99 HydrophobicContact CG-CB 3.87Å; M45-A99 HydrophobicContact SD-CB 4.22Å; F93-A99 HydrophobicContact CB-CB 4.22Å; F93-A99 HydrophobicContact CD2-CB 3.67Å; F93-A99 HydrophobicContact CE2-CB 4.37Å; F93-A99 HydrophobicContact CG-CB 4.16Å; T95-A99 PolarHBondContact O-N 2.96Å; R96-A99 WeakPolarHBondContact O-CB 3.02Å; R96-A99 PolarHBondContact O-N 2.86Å; K97-A99 VanDerWaalsContact C-N 3.34Å; K97-A99 PolarHBondContact O-N 3.16Å; A99-Q103 WeakPolarHBondContact O-CB 3.45Å; A99-Q103 PolarHBondContact O-N 2.83Å
100	L	89.3	Confident	87.9	Confident	84 Å²	84	56.1 Å²	56.1	44%	0.44	28%	0.275	S	S	.	.	H	α-helix	trans	-76.4	-37.6	177.2	-68.6	173.5	0	0	0	112.8	R96 K97 A98 Q103 N104	R96-L100 HydrophobicContact CG-CD1 3.96Å; R96-L100 HydrophobicContact CG-CG 4.28Å; R96-L100 WeakPolarHBondContact O-CG 3.42Å; R96-L100 PolarHBondContact O-N 2.71Å; K97-L100 PolarHBondContact O-N 2.98Å; A98-L100 VanDerWaalsContact C-N 3.33Å; A98-L100 PolarHBondContact O-N 2.96Å; L100-Q103 PolarHBondContact O-N 3.14Å; L100-N104 WeakPolarHBondContact O-CB 3.27Å; L100-N104 PolarHBondContact O-N 3.37Å
101	E	90.8	Very high	87.5	Confident	89 Å²	89	58.4 Å²	58.4	42%	0.416	29%	0.292	S	S	.	.	H	α-helix	trans	-66.3	-44.4	175.2	-74.1	174.8	129.5	0	0	111.2	K97 A98 Q103 N104 A105	K97-E101 WeakPolarHBondContact CG-OE2 3.1Å; K97-E101 IonicContact NZ-OE1 2.67Å; K97-E101 PolarHBondContact NZ-OE1 3.18Å; K97-E101 IonicContact NZ-OE2 2.69Å; K97-E101 PolarHBondContact NZ-OE2 2.6Å; K97-E101 WeakPolarHBondContact O-CG 3.43Å; K97-E101 PolarHBondContact O-N 3.37Å; A98-E101 PolarHBondContact O-N 2.68Å; E101-Q103 VanDerWaalsContact C-N 3.33Å; E101-Q103 PolarHBondContact O-N 2.93Å; E101-N104 PolarHBondContact O-N 3Å; E101-A105 WeakPolarHBondContact O-CB 3.43Å; E101-A105 PolarHBondContact O-N 3.08Å
102	A	90.3	Very high	87	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-41.9	170.1	0	0	0	0	0	111.8	Y66 F93 A98 A105 L106 M121	Y66-A102 HydrophobicContact CD2-CB 4.3Å; Y66-A102 HydrophobicContact CG-CB 4Å; F93-A102 HydrophobicContact CE1-CB 4.32Å; F93-A102 HydrophobicContact CE2-CB 4.19Å; F93-A102 HydrophobicContact CZ-CB 3.66Å; A98-A102 WeakPolarHBondContact O-CB 3.44Å; A98-A102 PolarHBondContact O-N 2.81Å; A102-A105 PolarHBondContact O-N 3.47Å; A102-L106 HydrophobicContact CB-CD1 4.5Å; A102-L106 VanDerWaalsContact O-CB 3.22Å; A102-L106 WeakPolarHBondContact O-CB 3.2Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.42Å; A102-L106 PolarHBondContact O-N 3.04Å; A102-M121 HydrophobicContact CB-CE 3.69Å; A102-M121 HydrophobicContact CB-SD 4.06Å
103	Q	90.8	Very high	86.3	Confident	42 Å²	42	62.8 Å²	62.8	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-49.3	175.8	-171.3	-179.9	11	0	0	111.3	M45 A99 L100 E101 A105 L106 H107 M121	M45-Q103 HydrophobicContact CE-CB 3.83Å; M45-Q103 HydrophobicContact CE-CG 4.06Å; A99-Q103 WeakPolarHBondContact O-CB 3.45Å; A99-Q103 PolarHBondContact O-N 2.83Å; L100-Q103 PolarHBondContact O-N 3.14Å; E101-Q103 VanDerWaalsContact C-N 3.33Å; E101-Q103 PolarHBondContact O-N 2.93Å; Q103-A105 VanDerWaalsContact C-N 3.32Å; Q103-A105 PolarHBondContact O-N 3.32Å; Q103-L106 PolarHBondContact O-N 2.79Å; Q103-H107 HydrophobicContact CG-CB 4.1Å; Q103-H107 WeakPolarHBondContact O-CB 3.36Å; Q103-H107 PolarHBondContact O-N 2.92Å; Q103-M121 HydrophobicContact CB-CG 4.18Å; Q103-M121 HydrophobicContact CB-SD 4.33Å; Q103-M121 HydrophobicContact CG-CB 4.33Å; Q103-M121 HydrophobicContact CG-CG 4.2Å; Q103-M121 PolarHBondContact NE2-O 3.34Å; Q103-M121 VanDerWaalsContact NE2-O 3.08Å
104	N	90	Very high	85.4	Confident	135 Å²	135	66.7 Å²	66.7	72%	0.722	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-36.7	-177.7	-166	42.4	0	0	0	112.3	L100 E101	L100-N104 WeakPolarHBondContact O-CB 3.27Å; L100-N104 PolarHBondContact O-N 3.37Å; E101-N104 PolarHBondContact O-N 3Å
105	A	88.1	Confident	84.8	Confident	38 Å²	38	65.7 Å²	65.7	31%	0.314	36%	0.359	S	S	.	.	H	α-helix	trans	-83.2	-19.6	-178.9	0	0	0	0	0	114.9	Y66 E101 A102 Q103	Y66-A105 HydrophobicContact CD1-CB 3.98Å; Y66-A105 HydrophobicContact CE1-CB 3.33Å; E101-A105 WeakPolarHBondContact O-CB 3.43Å; E101-A105 PolarHBondContact O-N 3.08Å; A102-A105 PolarHBondContact O-N 3.47Å; Q103-A105 VanDerWaalsContact C-N 3.32Å; Q103-A105 PolarHBondContact O-N 3.32Å
106	L	87.8	Confident	84	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-113	-35.8	-175.1	-60.9	173.7	0	0	0	113.5	L62 F63 Y66 A102 Q103 N108 M109 K110 I119 M121	L62-L106 HydrophobicContact CD1-CD2 4.32Å; F63-L106 HydrophobicContact CD1-CD1 3.73Å; F63-L106 HydrophobicContact CE1-CD1 3.4Å; F63-L106 HydrophobicContact CZ-CD1 4.47Å; Y66-L106 HydrophobicContact CD2-CD1 4.16Å; Y66-L106 HydrophobicContact CE2-CD1 3.8Å; Y66-L106 HydrophobicContact CE2-CD2 3.88Å; Y66-L106 HydrophobicContact CE2-CG 3.95Å; Y66-L106 WeakPolarHBondContact OH-CD2 3.18Å; A102-L106 HydrophobicContact CB-CD1 4.5Å; A102-L106 VanDerWaalsContact O-CB 3.22Å; A102-L106 WeakPolarHBondContact O-CB 3.2Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.42Å; A102-L106 PolarHBondContact O-N 3.04Å; Q103-L106 PolarHBondContact O-N 2.79Å; L106-N108 PolarHBondContact O-N 2.82Å; L106-M109 PolarHBondContact O-N 2.89Å; L106-M109 VanDerWaalsContact O-N 3.15Å; L106-K110 HydrophobicContact CD2-CB 3.87Å; L106-K110 HydrophobicContact CD2-CD 3.44Å; L106-K110 VanDerWaalsContact CD2-CD 3.44Å; L106-K110 HydrophobicContact CD2-CG 4.28Å; L106-K110 PolarHBondContact O-N 2.86Å; L106-I119 HydrophobicContact CB-CD1 4.42Å; L106-I119 HydrophobicContact CB-CG2 4.29Å; L106-I119 HydrophobicContact CD2-CD1 4.27Å; L106-M121 HydrophobicContact CD1-SD 4.35Å
107	H	88.3	Confident	83.9	Confident	50 Å²	50	70.6 Å²	70.6	23%	0.231	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	116.9	-173.8	-175.7	88	0	0	0	111.9	Q103 M109 I119 M121	Q103-H107 HydrophobicContact CG-CB 4.1Å; Q103-H107 WeakPolarHBondContact O-CB 3.36Å; Q103-H107 PolarHBondContact O-N 2.92Å; H107-M109 PolarHBondContact O-N 2.89Å; H107-I119 WeakPolarHBondContact CA-O 3.23Å; H107-M121 HydrophobicContact CB-CB 4.4Å; H107-M121 PolarHBondContact ND1-N 2.9Å; H107-M121 PolarHBondContact ND1-O 3.06Å
108	N	84.6	Confident	83.8	Confident	92 Å²	92	65.8 Å²	65.8	49%	0.492	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	0.9	-174	-60	-29.4	0	0	0	115.9	L106 P118 I119	L106-N108 PolarHBondContact O-N 2.82Å; N108-P118 VanDerWaalsContact C-CB 3.49Å; N108-P118 HydrophobicContact CB-CG 4.24Å; N108-P118 WeakPolarHBondContact O-CB 3.35Å; N108-I119 PolarHBondContact N-O 3Å
109	M	79.9	Confident	83.8	Confident	141 Å²	141	65.6 Å²	65.6	70%	0.695	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-44.1	-177.6	-64.4	-159	75.3	0	0	113.2	L106 H107	L106-M109 PolarHBondContact O-N 2.89Å; L106-M109 VanDerWaalsContact O-N 3.15Å; H107-M109 PolarHBondContact O-N 2.89Å
110	K	79.4	Confident	83.7	Confident	82 Å²	82	69.3 Å²	69.3	36%	0.357	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-99.4	116.6	-175.8	-163.5	170.5	-168.4	169.3	0	110.6	L62 L106 L112 P118 I119	L62-K110 HydrophobicContact CD1-CD 4.06Å; L106-K110 HydrophobicContact CD2-CB 3.87Å; L106-K110 HydrophobicContact CD2-CD 3.44Å; L106-K110 VanDerWaalsContact CD2-CD 3.44Å; L106-K110 HydrophobicContact CD2-CG 4.28Å; L106-K110 PolarHBondContact O-N 2.86Å; K110-L112 HydrophobicContact CD-CD2 4.49Å; K110-L112 HydrophobicContact CG-CD2 4.4Å; K110-P118 WeakPolarHBondContact O-CA 3.3Å; K110-I119 HydrophobicContact CB-CD1 4.18Å; K110-I119 HydrophobicContact CG-CD1 4.49Å; K110-I119 WeakPolarHBondContact O-CG1 3.38Å; K110-I119 PolarHBondContact O-N 3.12Å
111	V	83.4	Confident	83.8	Confident	84 Å²	84	65.3 Å²	65.3	51%	0.509	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-90.9	129.5	167.8	-174.1	0	0	0	0	108.2	M115 P118	V111-M115 WeakPolarHBondContact CG1-O 3.13Å; V111-P118 HydrophobicContact CG2-CB 3.87Å
112	L	81.1	Confident	83.7	Confident	6 Å²	6	66.6 Å²	66.6	3%	0.031	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-89.7	148.5	178	-66.7	-178.2	0	0	0	111.2	P51 W54 L62 K110 G114 M115 I119	P51-L112 VanDerWaalsContact CD-CD1 3.47Å; P51-L112 HydrophobicContact CG-CB 3.65Å; P51-L112 HydrophobicContact CG-CD1 4.29Å; W54-L112 HydrophobicContact CE3-CD1 4.14Å; W54-L112 HydrophobicContact CH2-CD1 4.09Å; W54-L112 HydrophobicContact CH2-CD2 3.59Å; W54-L112 HydrophobicContact CH2-CG 4.39Å; W54-L112 HydrophobicContact CZ2-CD1 4.42Å; W54-L112 HydrophobicContact CZ2-CD2 4.02Å; W54-L112 HydrophobicContact CZ3-CD1 3.95Å; W54-L112 HydrophobicContact CZ3-CD2 4.17Å; L62-L112 HydrophobicContact CD2-CD1 4.33Å; L62-L112 HydrophobicContact CD2-CD2 4.26Å; K110-L112 HydrophobicContact CD-CD2 4.49Å; K110-L112 HydrophobicContact CG-CD2 4.4Å; L112-G114 PolarHBondContact O-N 3.4Å; L112-M115 HydrophobicContact CB-CG 4.35Å; L112-M115 WeakPolarHBondContact O-CB 3.47Å; L112-M115 PolarHBondContact O-N 2.71Å; L112-I119 HydrophobicContact CD1-CD1 3.78Å; L112-I119 HydrophobicContact CD1-CG1 3.93Å; L112-I119 HydrophobicContact CD2-CD1 4.08Å; L112-I119 HydrophobicContact CG-CD1 3.79Å; L112-I119 HydrophobicContact CG-CG1 3.92Å
113	P	73.9	Confident	83.6	Confident	97 Å²	97	69.5 Å²	69.5	63%	0.63	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	128.4	-177.3	23.4	-33.9	0	0	0	111.1	P51 W54	P51-P113 WeakPolarHBondContact CG-O 3.46Å; W54-P113 HydrophobicContact CZ2-CG 4.35Å
114	G	70.3	Confident	83.1	Confident	82 Å²	82	68.1 Å²	68.1	85%	0.845	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	2.6	-174.3	0	0	0	0	0	115.5	L112	L112-G114 PolarHBondContact O-N 3.4Å
115	M	75.1	Confident	82	Confident	52 Å²	52	67.4 Å²	67.4	26%	0.256	37%	0.374	S	S	.	.			trans	-104.4	139.3	171.9	-63.5	-91.8	62.4	0	0	111.6	Q49 P51 V111 L112 H117	Q49-M115 HydrophobicContact CB-SD 4.32Å; P51-M115 HydrophobicContact CB-CG 4.48Å; P51-M115 HydrophobicContact CG-CG 3.84Å; V111-M115 WeakPolarHBondContact CG1-O 3.13Å; L112-M115 HydrophobicContact CB-CG 4.35Å; L112-M115 WeakPolarHBondContact O-CB 3.47Å; L112-M115 PolarHBondContact O-N 2.71Å; M115-H117 VanDerWaalsContact C-N 3.34Å
116	H	70.1	Confident	80.7	Confident	175 Å²	175	69.1 Å²	69.1	81%	0.81	38%	0.383	S	S	*	.	S	Bend	trans	-91.3	1	176.1	-163.3	-67.5	0	0	0	112.5
117	H	82.1	Confident	79.4	Confident	94 Å²	94	74.5 Å²	74.5	44%	0.435	41%	0.408	S	S	.	.	S	Bend	trans	-137.5	147.5	-179.7	-61.8	-53.1	0	0	0	109.7	Q49 M115	Q49-H117 HydrophobicContact CB-CB 4.47Å; Q49-H117 HydrophobicContact CG-CB 3.8Å; M115-H117 VanDerWaalsContact C-N 3.34Å
118	P	85.3	Confident	77.7	Confident	32 Å²	32	79.1 Å²	79.1	21%	0.208	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-70.6	160.2	175.7	31.1	-36.8	0	0	0	112.2	Q49 N108 K110 V111 Q120	Q49-P118 WeakPolarHBondContact CB-O 3.42Å; Q49-P118 WeakPolarHBondContact CG-O 3.21Å; N108-P118 VanDerWaalsContact C-CB 3.49Å; N108-P118 HydrophobicContact CB-CG 4.24Å; N108-P118 WeakPolarHBondContact O-CB 3.35Å; K110-P118 WeakPolarHBondContact O-CA 3.3Å; V111-P118 HydrophobicContact CG2-CB 3.87Å; P118-Q120 PolarHBondContact O-N 3.43Å
119	I	89	Confident	76.5	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.005	43%	0.43	C	S	.	.			trans	-52.9	131.6	176.3	-67.5	172	0	0	0	110.4	V47 L62 L106 H107 N108 K110 L112 M121	V47-I119 HydrophobicContact CG1-CG2 3.66Å; L62-I119 HydrophobicContact CD2-CD1 4.01Å; L106-I119 HydrophobicContact CB-CD1 4.42Å; L106-I119 HydrophobicContact CB-CG2 4.29Å; L106-I119 HydrophobicContact CD2-CD1 4.27Å; H107-I119 WeakPolarHBondContact CA-O 3.23Å; N108-I119 PolarHBondContact N-O 3Å; K110-I119 HydrophobicContact CB-CD1 4.18Å; K110-I119 HydrophobicContact CG-CD1 4.49Å; K110-I119 WeakPolarHBondContact O-CG1 3.38Å; K110-I119 PolarHBondContact O-N 3.12Å; L112-I119 HydrophobicContact CD1-CD1 3.78Å; L112-I119 HydrophobicContact CD1-CG1 3.93Å; L112-I119 HydrophobicContact CD2-CD1 4.08Å; L112-I119 HydrophobicContact CG-CD1 3.79Å; L112-I119 HydrophobicContact CG-CG1 3.92Å; I119-M121 HydrophobicContact CG2-CB 4.26Å
120	Q	88.3	Confident	75.6	Confident	79 Å²	79	76.7 Å²	76.7	37%	0.369	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	81.6	176.8	-65	-170.9	5.3	0	0	110.5	G48 Q49 P118	G48-Q120 PolarHBondContact N-O 3.27Å; G48-Q120 PolarHBondContact O-N 3.24Å; Q49-Q120 HydrophobicContact CG-CG 4.16Å; P118-Q120 PolarHBondContact O-N 3.43Å
121	M	90.9	Very high	74.8	Confident	0 Å²	0	75 Å²	75	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.9	178.8	-172.6	163.2	179	0	0	112	M45 F46 V47 F63 V91 F93 A102 Q103 L106 H107 I119	M45-M121 HydrophobicContact CB-CE 3.78Å; M45-M121 HydrophobicContact CB-CG 4.43Å; M45-M121 HydrophobicContact CE-CE 4.01Å; M45-M121 HydrophobicContact CE-CG 4.08Å; M45-M121 HydrophobicContact CG-CE 3.76Å; F46-M121 CarbonylContact O-C 3.54Å; F46-M121 VanDerWaalsContact O-CA 3.3Å; F46-M121 WeakPolarHBondContact O-CA 3.4Å; V47-M121 HydrophobicContact CG2-CG 4.18Å; V47-M121 HydrophobicContact CG2-SD 4.46Å; F63-M121 HydrophobicContact CE1-CE 4.47Å; F63-M121 HydrophobicContact CE1-SD 3.99Å; V91-M121 HydrophobicContact CG1-CE 4.29Å; F93-M121 HydrophobicContact CE2-CE 3.68Å; F93-M121 HydrophobicContact CZ-CE 4.27Å; A102-M121 HydrophobicContact CB-CE 3.69Å; A102-M121 HydrophobicContact CB-SD 4.06Å; Q103-M121 HydrophobicContact CB-CG 4.18Å; Q103-M121 HydrophobicContact CB-SD 4.33Å; Q103-M121 HydrophobicContact CG-CB 4.33Å; Q103-M121 HydrophobicContact CG-CG 4.2Å; Q103-M121 PolarHBondContact NE2-O 3.34Å; Q103-M121 VanDerWaalsContact NE2-O 3.08Å; L106-M121 HydrophobicContact CD1-SD 4.35Å; H107-M121 HydrophobicContact CB-CB 4.4Å; H107-M121 PolarHBondContact ND1-N 2.9Å; H107-M121 PolarHBondContact ND1-O 3.06Å; I119-M121 HydrophobicContact CG2-CB 4.26Å
122	K	89.6	Confident	74	Confident	116 Å²	116	73 Å²	73	50%	0.504	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.7	179.1	-68.2	-172.1	177.4	-175.6	0	110.8	M45 F46	M45-K122 CarbonylContact C-O 3.45Å; M45-K122 VanDerWaalsContact CA-O 3.31Å; M45-K122 WeakPolarHBondContact CA-O 3.32Å; F46-K122 PolarHBondContact N-O 2.73Å; F46-K122 PolarHBondContact O-N 2.82Å
123	P	87.2	Confident	73.4	Confident	62 Å²	62	74.6 Å²	74.6	40%	0.403	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	141.6	165.1	-24.4	35	0	0	0	111.4	I43 M45	I43-P123 HydrophobicContact CG2-CB 4.28Å; M45-P123 HydrophobicContact CE-CG 4.3Å; M45-P123 HydrophobicContact SD-CB 4.27Å; M45-P123 HydrophobicContact SD-CG 4.17Å
124	A	80.8	Confident	73.4	Confident	13 Å²	13	72.7 Å²	72.7	11%	0.107	40%	0.399	C	S	.	.			trans	-90.4	121.2	-179.1	0	0	0	0	0	111.9	K44 F46 F90 S126	K44-A124 HydrophobicContact CB-CB 4.37Å; K44-A124 HydrophobicContact CG-CB 4.37Å; K44-A124 WeakPolarHBondContact O-CB 3.43Å; K44-A124 PolarHBondContact O-N 3.4Å; F46-A124 HydrophobicContact CB-CB 4.42Å; F90-A124 HydrophobicContact CD1-CB 3.8Å; F90-A124 HydrophobicContact CE1-CB 3.68Å; A124-S126 PolarHBondContact O-N 2.79Å
125	D	67.8	Low	74.2	Confident	120 Å²	120	70.9 Å²	70.9	64%	0.642	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-4.7	175.1	-64.5	-61.4	0	0	0	114.1	E127 K128 N129	D125-E127 PolarHBondContact O-N 2.86Å; D125-K128 PolarHBondContact O-N 2.9Å; D125-N129 PolarHBondContact O-N 3.31Å
126	S	61	Low	74.9	Confident	74 Å²	74	70.5 Å²	70.5	52%	0.517	36%	0.363	S	S	.	.	H	α-helix	trans	-62	-38.9	-171.7	-166.5	0	0	0	0	113.4	A124 N130	A124-S126 PolarHBondContact O-N 2.79Å; S126-N130 WeakPolarHBondContact O-CB 3.3Å; S126-N130 PolarHBondContact O-N 2.91Å
127	E	59.3	Low	75.9	Confident	112 Å²	112	62.1 Å²	62.1	52%	0.523	33%	0.325	S	S	.	.	H	α-helix	trans	-76.5	-40.5	179	-71	175.8	93.1	0	0	111.5	K44 D125 N129 N130 A131	K44-E127 WeakPolarHBondContact CB-OE2 3.29Å; D125-E127 PolarHBondContact O-N 2.86Å; E127-N129 VanDerWaalsContact C-N 3.33Å; E127-N129 PolarHBondContact O-N 3.24Å; E127-N130 PolarHBondContact O-N 2.85Å; E127-A131 WeakPolarHBondContact O-CB 3.1Å; E127-A131 PolarHBondContact O-N 2.93Å
128	K	53.4	Low	76.4	Confident	148 Å²	148	60.8 Å²	60.8	64%	0.643	32%	0.317	S	S	*	.	H	α-helix	trans	-58.5	-45.5	176.6	-71.3	-177.5	179.1	175.9	0	111.7	D125 V132	D125-K128 PolarHBondContact O-N 2.9Å; K128-V132 WeakPolarHBondContact O-CB 3.21Å; K128-V132 VanDerWaalsContact O-CG2 3.22Å; K128-V132 WeakPolarHBondContact O-CG2 3.38Å; K128-V132 PolarHBondContact O-N 3.4Å
129	N	58.9	Low	76.7	Confident	101 Å²	101	59.2 Å²	59.2	54%	0.54	31%	0.307	S	S	.	.	H	α-helix	trans	-66.9	-47.7	-179.1	-158	12.5	0	0	0	110.9	D125 E127 V132 E133	D125-N129 PolarHBondContact O-N 3.31Å; E127-N129 VanDerWaalsContact C-N 3.33Å; E127-N129 PolarHBondContact O-N 3.24Å; N129-V132 PolarHBondContact O-N 3.25Å; N129-V132 VanDerWaalsContact O-N 3.16Å; N129-E133 WeakPolarHBondContact O-CG 3.41Å; N129-E133 PolarHBondContact O-N 2.91Å
130	N	60.5	Low	76.7	Confident	80 Å²	80	59.4 Å²	59.4	43%	0.428	31%	0.309	S	S	.	.	H	α-helix	trans	-72.3	-35.2	-176.9	-162.8	-127.2	0	0	0	113.4	S126 E127 V132 E133 D134	S126-N130 WeakPolarHBondContact O-CB 3.3Å; S126-N130 PolarHBondContact O-N 2.91Å; E127-N130 PolarHBondContact O-N 2.85Å; N130-V132 VanDerWaalsContact C-N 3.28Å; N130-V132 PolarHBondContact O-N 3.2Å; N130-E133 WeakPolarHBondContact CA-OE2 3.38Å; N130-E133 PolarHBondContact ND2-OE2 3.09Å; N130-E133 PolarHBondContact O-N 3.06Å; N130-D134 PolarHBondContact O-N 2.77Å
131	A	63.3	Low	76.8	Confident	48 Å²	48	60.5 Å²	60.5	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-69	-23.4	170.9	0	0	0	0	0	112.9	E127 R135	E127-A131 WeakPolarHBondContact O-CB 3.1Å; E127-A131 PolarHBondContact O-N 2.93Å; A131-R135 VanDerWaalsContact O-CG 3.28Å; A131-R135 WeakPolarHBondContact O-CG 3.45Å; A131-R135 PolarHBondContact O-NE 3.12Å
132	V	65.3	Low	76.6	Confident	40 Å²	40	60.9 Å²	60.9	24%	0.242	32%	0.318	C	S	.	.	H	α-helix	trans	-76.9	-44.2	168.6	163.7	0	0	0	0	110.7	K128 N129 N130 D134 R135 K136 T181	K128-V132 WeakPolarHBondContact O-CB 3.21Å; K128-V132 VanDerWaalsContact O-CG2 3.22Å; K128-V132 WeakPolarHBondContact O-CG2 3.38Å; K128-V132 PolarHBondContact O-N 3.4Å; N129-V132 PolarHBondContact O-N 3.25Å; N129-V132 VanDerWaalsContact O-N 3.16Å; N130-V132 VanDerWaalsContact C-N 3.28Å; N130-V132 PolarHBondContact O-N 3.2Å; V132-D134 VanDerWaalsContact C-N 3.35Å; V132-D134 PolarHBondContact O-N 2.88Å; V132-R135 CarbonylContact O-C 3.47Å; V132-R135 PolarHBondContact O-N 2.98Å; V132-K136 WeakPolarHBondContact O-CB 3.4Å; V132-K136 PolarHBondContact O-N 3.14Å; V132-T181 HydrophobicContact CG1-CG2 4.1Å
133	E	68.8	Low	76.4	Confident	40 Å²	40	56.3 Å²	56.3	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-53.7	-49.6	174.5	-71.6	172.4	143.9	0	0	111.2	N129 N130 R135 K136 T215	N129-E133 WeakPolarHBondContact O-CG 3.41Å; N129-E133 PolarHBondContact O-N 2.91Å; N130-E133 WeakPolarHBondContact CA-OE2 3.38Å; N130-E133 PolarHBondContact ND2-OE2 3.09Å; N130-E133 PolarHBondContact O-N 3.06Å; E133-R135 PolarHBondContact O-N 3.11Å; E133-R135 VanDerWaalsContact O-N 3.1Å; E133-K136 PolarHBondContact O-N 2.62Å; E133-K136 VanDerWaalsContact O-N 3.09Å; E133-T215 HydrophobicContact CB-CG2 4.28Å; E133-T215 HydrophobicContact CG-CG2 4.33Å
134	D	74.6	Confident	76.2	Confident	58 Å²	58	60.2 Å²	60.2	31%	0.31	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.5	178.5	-101.1	-10.9	0	0	0	115	N130 V132 R185 F212	N130-D134 PolarHBondContact O-N 2.77Å; V132-D134 VanDerWaalsContact C-N 3.35Å; V132-D134 PolarHBondContact O-N 2.88Å; D134-R185 IonicContact OD1-CZ 2.67Å; D134-R185 VanDerWaalsContact OD1-CZ 3.31Å; D134-R185 IonicContact OD1-NH1 3.12Å; D134-R185 IonicContact OD1-NH2 3.52Å; D134-R185 PolarHBondContact OD1-NH2 2.58Å; D134-R185 IonicContact OD2-CZ 3.39Å; D134-R185 VanDerWaalsContact OD2-CZ 3.26Å; D134-R185 IonicContact OD2-NH1 2.91Å; D134-R185 PolarHBondContact OD2-NH1 3.16Å; D134-R185 IonicContact OD2-NH2 2.66Å; D134-R185 PolarHBondContact OD2-NH2 3.38Å; D134-F212 WeakPolarHBondContact O-CE1 3.27Å
135	R	86.3	Confident	76.3	Confident	43 Å²	43	68.7 Å²	68.7	16%	0.162	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-0.3	176.1	-66.6	-176.7	-65.5	125.1	-5.9	113.4	A131 V132 E133 E162 T181 F182 T183 R185	A131-R135 VanDerWaalsContact O-CG 3.28Å; A131-R135 WeakPolarHBondContact O-CG 3.45Å; A131-R135 PolarHBondContact O-NE 3.12Å; V132-R135 CarbonylContact O-C 3.47Å; V132-R135 PolarHBondContact O-N 2.98Å; E133-R135 PolarHBondContact O-N 3.11Å; E133-R135 VanDerWaalsContact O-N 3.1Å; R135-E162 IonicContact CZ-OE2 3.95Å; R135-E162 IonicContact NH1-OE2 2.73Å; R135-E162 PolarHBondContact NH1-OE2 3.49Å; R135-E162 IonicContact NH2-OE2 3.93Å; R135-E162 PolarHBondContact NH2-OE2 2.93Å; R135-T181 HydrophobicContact CB-CG2 4.41Å; R135-F182 WeakPolarHBondContact CB-O 3.4Å; R135-F182 WeakPolarHBondContact CD-O 3.34Å; R135-F182 PolarHBondContact NH1-O 3.07Å; R135-F182 PolarHBondContact O-N 2.92Å; R135-F182 VanDerWaalsContact O-N 3.14Å; R135-T183 WeakPolarHBondContact CD-O 3.35Å; R135-T183 PolarHBondContact NH1-O 2.91Å; R135-R185 HydrophobicContact CG-CB 4.3Å
136	K	90.4	Very high	77	Confident	44 Å²	44	63.8 Å²	63.8	19%	0.191	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.5	-175.8	-165.5	158.5	-168.2	147.1	0	110.8	V132 E133 E163 F179 A213	V132-K136 WeakPolarHBondContact O-CB 3.4Å; V132-K136 PolarHBondContact O-N 3.14Å; E133-K136 PolarHBondContact O-N 2.62Å; E133-K136 VanDerWaalsContact O-N 3.09Å; K136-E163 IonicContact NZ-OE1 3.26Å; K136-E163 PolarHBondContact NZ-OE1 2.84Å; K136-E163 IonicContact NZ-OE2 2.84Å; K136-E163 PolarHBondContact NZ-OE2 2.62Å; K136-F179 HydrophobicContact CG-CB 4.48Å; K136-F179 HydrophobicContact CG-CD1 4.33Å; K136-A213 HydrophobicContact CB-CB 4.28Å; K136-A213 HydrophobicContact CG-CB 4.13Å; K136-A213 WeakPolarHBondContact O-CB 3.18Å; K136-A213 PolarHBondContact O-N 2.76Å
137	L	91.7	Very high	78.3	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.4	173.2	-57.8	-170.6	0	0	0	110.7	F179 V180 F182 A188 A191 I192 V210 K211 F212	L137-F179 VanDerWaalsContact O-CA 3.28Å; L137-F179 WeakPolarHBondContact O-CA 3.3Å; L137-V180 PolarHBondContact N-O 3.43Å; L137-V180 PolarHBondContact O-N 3.09Å; L137-F182 HydrophobicContact CD1-CD2 4.14Å; L137-F182 HydrophobicContact CD1-CE2 3.73Å; L137-F182 HydrophobicContact CG-CD2 4.37Å; L137-F182 HydrophobicContact CG-CE2 4.38Å; L137-A188 HydrophobicContact CD1-CB 4.4Å; L137-A188 HydrophobicContact CD2-CB 3.95Å; L137-A188 HydrophobicContact CG-CB 4.17Å; L137-A191 HydrophobicContact CD1-CB 3.95Å; L137-I192 HydrophobicContact CD1-CG1 4.08Å; L137-I192 HydrophobicContact CD2-CD1 3.6Å; L137-I192 HydrophobicContact CD2-CG1 3.73Å; L137-V210 HydrophobicContact CB-CG1 4.49Å; L137-V210 HydrophobicContact CD1-CG1 3.71Å; L137-K211 CarbonylContact C-O 3.57Å; L137-K211 WeakPolarHBondContact CA-O 3.3Å; L137-F212 HydrophobicContact CD2-CD1 3.87Å; L137-F212 HydrophobicContact CD2-CE1 4.1Å; L137-F212 HydrophobicContact CD2-CG 4.36Å
138	F	92.9	Very high	79.7	Confident	65 Å²	65	60.5 Å²	60.5	29%	0.285	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	130.3	158.2	175	-98.9	0	0	0	109	C177 F179 V210 K211 A213	F138-C177 HydrophobicContact CE2-CB 3.58Å; F138-C177 HydrophobicContact CZ-CB 3.56Å; F138-F179 HydrophobicContact CB-CD1 4.24Å; F138-F179 HydrophobicContact CB-CE1 3.98Å; F138-F179 HydrophobicContact CD2-CD1 4.3Å; F138-F179 AromaticContact CD2-CE1 3.75Å; F138-F179 HydrophobicContact CD2-CE1 3.75Å; F138-F179 AromaticContact CD2-CZ 3.9Å; F138-F179 HydrophobicContact CD2-CZ 3.9Å; F138-F179 HydrophobicContact CG-CE1 4.36Å; F138-V210 WeakPolarHBondContact O-CA 3.18Å; F138-K211 PolarHBondContact N-O 3.25Å; F138-K211 PolarHBondContact O-N 2.6Å; F138-A213 HydrophobicContact CB-CB 4.46Å
139	I	91.1	Very high	81.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	108	176.1	-58.3	166	0	0	0	106.7	I142 I151 F155 C177 A178 V180 M208 V209 V210	I139-I142 HydrophobicContact CG2-CG2 3.66Å; I139-I151 HydrophobicContact CD1-CG2 3.9Å; I139-F155 HydrophobicContact CD1-CD1 4.16Å; I139-F155 HydrophobicContact CD1-CD2 4.06Å; I139-F155 HydrophobicContact CD1-CE1 3.79Å; I139-F155 HydrophobicContact CD1-CE2 3.7Å; I139-F155 HydrophobicContact CD1-CG 4.29Å; I139-F155 HydrophobicContact CD1-CZ 3.55Å; I139-F155 HydrophobicContact CG1-CE1 4.23Å; I139-F155 HydrophobicContact CG1-CE2 4.5Å; I139-F155 HydrophobicContact CG1-CZ 3.96Å; I139-F155 HydrophobicContact CG2-CE2 4.45Å; I139-F155 HydrophobicContact CG2-CZ 4.24Å; I139-C177 CarbonylContact O-C 3.59Å; I139-C177 WeakPolarHBondContact O-CA 3.45Å; I139-C177 VanDerWaalsContact O-CB 3.32Å; I139-C177 WeakPolarHBondContact O-CB 3.38Å; I139-A178 PolarHBondContact N-O 3.29Å; I139-A178 PolarHBondContact O-N 3.08Å; I139-V180 HydrophobicContact CD1-CB 3.93Å; I139-V180 HydrophobicContact CD1-CG2 3.49Å; I139-V180 VanDerWaalsContact CD1-CG2 3.49Å; I139-M208 HydrophobicContact CG2-CG 3.81Å; I139-M208 HydrophobicContact CG2-SD 3.5Å; I139-M208 VanDerWaalsContact CG2-SD 3.5Å; I139-V209 WeakPolarHBondContact CA-O 3.36Å; I139-V210 HydrophobicContact CG1-CG1 4.39Å; I139-V210 HydrophobicContact CG1-CG2 4.47Å; I139-V210 HydrophobicContact CG2-CG2 4.45Å
140	G	89.1	Confident	82.9	Confident	4 Å²	4	57 Å²	57	4%	0.041	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	168.2	175.9	0	0	0	0	0	113	I142 G176 M208 V209	G140-I142 VanDerWaalsContact C-N 3.34Å; G140-I142 PolarHBondContact O-N 2.82Å; G140-G176 CarbonylContact C-O 3.58Å; G140-M208 WeakPolarHBondContact O-CG 3.44Å; G140-V209 PolarHBondContact N-O 3.27Å; G140-V209 PolarHBondContact O-N 3.17Å
141	M	89	Confident	84.2	Confident	103 Å²	103	53.5 Å²	53.5	51%	0.507	27%	0.27	S	S	.	.	S	Bend	trans	59.2	40	-179	-50.1	-52.3	178.1	0	0	113.7	G176 V209	M141-G176 PolarHBondContact N-O 2.83Å; M141-V209 HydrophobicContact CB-CG2 4.41Å; M141-V209 HydrophobicContact CG-CG2 3.86Å
142	I	87.7	Confident	85.5	Confident	8 Å²	8	55.8 Å²	55.8	4%	0.041	27%	0.269	C	S	.	.			trans	-94.2	153.7	168.1	54.1	167.9	0	0	0	110.9	I139 G140 I151 G176 A178 M208	I139-I142 HydrophobicContact CG2-CG2 3.66Å; G140-I142 VanDerWaalsContact C-N 3.34Å; G140-I142 PolarHBondContact O-N 2.82Å; I142-I151 HydrophobicContact CD1-CD1 3.56Å; I142-I151 HydrophobicContact CD1-CG1 4.38Å; I142-G176 WeakPolarHBondContact CG1-O 3.33Å; I142-G176 PolarHBondContact N-O 2.91Å; I142-G176 VanDerWaalsContact N-O 3.08Å; I142-G176 WeakPolarHBondContact O-CA 3.22Å; I142-A178 HydrophobicContact CD1-CB 3.93Å; I142-M208 HydrophobicContact CG2-CG 3.9Å; I142-M208 HydrophobicContact CG2-SD 3.53Å; I142-M208 VanDerWaalsContact CG2-SD 3.53Å
143	S	84.4	Confident	86.7	Confident	19 Å²	19	58.4 Å²	58.4	13%	0.133	28%	0.284	C	S	.	.			trans	-65.3	141.9	-179.8	-168.4	0	0	0	0	111.2	K145 C146 E202	S143-K145 PolarHBondContact O-N 3.34Å; S143-C146 WeakPolarHBondContact O-CB 3.45Å; S143-C146 PolarHBondContact O-N 2.93Å; S143-C146 PolarHBondContact O-SG 3.32Å; S143-C146 VanDerWaalsContact O-SG 3.37Å; S143-E202 PolarHBondContact OG-O 3.04Å
144	K	83.1	Confident	87.6	Confident	144 Å²	144	58.7 Å²	58.7	63%	0.626	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.7	-177.9	-62.8	-171.9	179.4	-179.1	0	113.7	S174	K144-S174 WeakPolarHBondContact CG-O 3.4Å; K144-S174 WeakPolarHBondContact O-CB 3.38Å
145	K	82.7	Confident	88.2	Confident	191 Å²	191	56 Å²	56	83%	0.83	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-17.2	175.5	-66.3	-179.8	179.4	178.7	0	113.7	S143	S143-K145 PolarHBondContact O-N 3.34Å
146	C	83.4	Confident	88.5	Confident	18 Å²	18	57.3 Å²	57.3	12%	0.122	29%	0.288	C	S	.	.			trans	-63.4	142.3	-179.4	-58.7	0	0	0	0	111.2	S143 I166	S143-C146 WeakPolarHBondContact O-CB 3.45Å; S143-C146 PolarHBondContact O-N 2.93Å; S143-C146 PolarHBondContact O-SG 3.32Å; S143-C146 VanDerWaalsContact O-SG 3.37Å; C146-I166 WeakPolarHBondContact O-CD1 3.46Å
147	T	88.2	Confident	88.5	Confident	58 Å²	58	60 Å²	60	36%	0.356	31%	0.312	S	S	.	.			trans	-105.4	165.3	174	70	0	0	0	0	111.3	N149 D150 I151 I166	T147-N149 PolarHBondContact O-N 3.48Å; T147-N149 VanDerWaalsContact O-N 3.16Å; T147-N149 PolarHBondContact OG1-N 3.02Å; T147-D150 WeakPolarHBondContact CA-OD2 3.38Å; T147-D150 WeakPolarHBondContact CB-OD2 3.42Å; T147-D150 PolarHBondContact N-OD2 3.33Å; T147-D150 PolarHBondContact O-N 3.24Å; T147-D150 PolarHBondContact OG1-N 3.26Å; T147-D150 PolarHBondContact OG1-OD2 3.15Å; T147-I151 WeakPolarHBondContact O-CG1 3.37Å; T147-I151 PolarHBondContact O-N 3.49Å; T147-I166 VanDerWaalsContact C-CD1 3.42Å
148	E	88.4	Confident	88.3	Confident	59 Å²	59	62.5 Å²	62.5	28%	0.276	32%	0.323	S	S	.	.	H	α-helix	trans	-54.9	-27.8	171.7	-73.2	78.7	178	0	0	112.6	R152 I166 R168	E148-R152 VanDerWaalsContact O-CB 3.28Å; E148-R152 WeakPolarHBondContact O-CB 3.47Å; E148-R152 PolarHBondContact O-N 2.61Å; E148-R152 VanDerWaalsContact O-N 3.07Å; E148-I166 HydrophobicContact CG-CD1 4.47Å; E148-I166 HydrophobicContact CG-CG1 4.06Å; E148-I166 VanDerWaalsContact OE1-CB 3.29Å; E148-I166 WeakPolarHBondContact OE1-CB 3.45Å; E148-I166 PolarHBondContact OE1-N 3.32Å; E148-I166 VanDerWaalsContact OE1-N 3.09Å; E148-R168 IonicContact OE1-NE 3.31Å; E148-R168 IonicContact OE1-NH2 3.9Å; E148-R168 PolarHBondContact OE1-NH2 2.81Å; E148-R168 IonicContact OE2-NH2 3.37Å; E148-R168 PolarHBondContact OE2-NH2 3.07Å
149	N	90.3	Very high	88.1	Confident	100 Å²	100	60 Å²	60	54%	0.535	32%	0.316	S	S	.	.	H	α-helix	trans	-71.5	-45.9	176.3	-176.2	75.8	0	0	0	112.2	T147 I151 R152 V153	T147-N149 PolarHBondContact O-N 3.48Å; T147-N149 VanDerWaalsContact O-N 3.16Å; T147-N149 PolarHBondContact OG1-N 3.02Å; N149-I151 VanDerWaalsContact C-N 3.3Å; N149-I151 PolarHBondContact O-N 3.15Å; N149-R152 WeakPolarHBondContact O-CB 3.5Å; N149-R152 PolarHBondContact O-N 2.92Å; N149-R152 VanDerWaalsContact O-N 3.11Å; N149-V153 WeakPolarHBondContact O-CG2 3.21Å; N149-V153 PolarHBondContact O-N 3.19Å
150	D	89.3	Confident	88.1	Confident	76 Å²	76	66.5 Å²	66.5	41%	0.406	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-39.9	-177.7	-47.7	-48.7	0	0	0	111	T147 V153 M154	T147-D150 WeakPolarHBondContact CA-OD2 3.38Å; T147-D150 WeakPolarHBondContact CB-OD2 3.42Å; T147-D150 PolarHBondContact N-OD2 3.33Å; T147-D150 PolarHBondContact O-N 3.24Å; T147-D150 PolarHBondContact OG1-N 3.26Å; T147-D150 PolarHBondContact OG1-OD2 3.15Å; D150-V153 PolarHBondContact O-N 3.05Å; D150-M154 VanDerWaalsContact O-CB 3.29Å; D150-M154 WeakPolarHBondContact O-CB 3.28Å; D150-M154 PolarHBondContact O-N 2.69Å
151	I	88.8	Confident	88.2	Confident	6 Å²	6	66.9 Å²	66.9	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-65.9	-42.9	173.9	-57.9	170.1	0	0	0	110.2	I139 I142 T147 N149 M154 F155 I166 A178 V180	I139-I151 HydrophobicContact CD1-CG2 3.9Å; I142-I151 HydrophobicContact CD1-CD1 3.56Å; I142-I151 HydrophobicContact CD1-CG1 4.38Å; T147-I151 WeakPolarHBondContact O-CG1 3.37Å; T147-I151 PolarHBondContact O-N 3.49Å; N149-I151 VanDerWaalsContact C-N 3.3Å; N149-I151 PolarHBondContact O-N 3.15Å; I151-M154 PolarHBondContact O-N 3.04Å; I151-F155 HydrophobicContact CG2-CD2 3.97Å; I151-F155 HydrophobicContact CG2-CE2 4.39Å; I151-F155 WeakPolarHBondContact O-CB 3.45Å; I151-F155 WeakPolarHBondContact O-CD2 3.38Å; I151-F155 PolarHBondContact O-N 2.7Å; I151-I166 HydrophobicContact CD1-CD1 3.78Å; I151-I166 HydrophobicContact CD1-CG1 3.65Å; I151-A178 HydrophobicContact CD1-CB 3.59Å; I151-V180 HydrophobicContact CG2-CG2 3.71Å
152	R	90.4	Very high	88.1	Confident	95 Å²	95	67.1 Å²	67.1	36%	0.358	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-44.8	176.5	-177.7	175.9	-74.3	-86.2	3	111.4	E148 N149 S156 I161 E162	E148-R152 VanDerWaalsContact O-CB 3.28Å; E148-R152 WeakPolarHBondContact O-CB 3.47Å; E148-R152 PolarHBondContact O-N 2.61Å; E148-R152 VanDerWaalsContact O-N 3.07Å; N149-R152 WeakPolarHBondContact O-CB 3.5Å; N149-R152 PolarHBondContact O-N 2.92Å; N149-R152 VanDerWaalsContact O-N 3.11Å; R152-S156 WeakPolarHBondContact O-CB 3.12Å; R152-S156 PolarHBondContact O-N 3.19Å; R152-I161 HydrophobicContact CG-CD1 4.27Å; R152-I161 PolarHBondContact NH1-O 2.93Å; R152-E162 PolarHBondContact NH2-O 3.36Å
153	V	90.3	Very high	88	Confident	95 Å²	95	69.9 Å²	69.9	58%	0.576	36%	0.36	S	S	*	.	H	α-helix	trans	-61.7	-49.8	175.8	172.1	0	0	0	0	110.9	N149 D150 F155 S156	N149-V153 WeakPolarHBondContact O-CG2 3.21Å; N149-V153 PolarHBondContact O-N 3.19Å; D150-V153 PolarHBondContact O-N 3.05Å; V153-F155 VanDerWaalsContact C-N 3.33Å; V153-F155 PolarHBondContact O-N 3.45Å; V153-S156 PolarHBondContact O-N 2.96Å
154	M	87	Confident	88.3	Confident	47 Å²	47	69.8 Å²	69.8	23%	0.232	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-37.9	-179.5	178.9	176.8	-76.4	0	0	113.1	D150 I151 F158 M195 M201 M208	D150-M154 VanDerWaalsContact O-CB 3.29Å; D150-M154 WeakPolarHBondContact O-CB 3.28Å; D150-M154 PolarHBondContact O-N 2.69Å; I151-M154 PolarHBondContact O-N 3.04Å; M154-F158 WeakPolarHBondContact O-CE2 3.43Å; M154-M195 HydrophobicContact CG-CE 3.66Å; M154-M195 HydrophobicContact SD-CE 3.7Å; M154-M201 HydrophobicContact CE-CE 4.35Å; M154-M201 HydrophobicContact CE-SD 3.95Å; M154-M208 HydrophobicContact SD-CE 4.04Å; M154-M208 HydrophobicContact SD-SD 4.37Å
155	F	88.8	Confident	88.6	Confident	1 Å²	1	70.7 Å²	70.7	0%	0.004	36%	0.358	C	S	.	.	H	α-helix	trans	-94.3	-16.8	-176.2	-79.3	-101.2	0	0	0	114.3	I139 I151 V153 S157 F158 I161 F182 A191 M195 M208 V210	I139-F155 HydrophobicContact CD1-CD1 4.16Å; I139-F155 HydrophobicContact CD1-CD2 4.06Å; I139-F155 HydrophobicContact CD1-CE1 3.79Å; I139-F155 HydrophobicContact CD1-CE2 3.7Å; I139-F155 HydrophobicContact CD1-CG 4.29Å; I139-F155 HydrophobicContact CD1-CZ 3.55Å; I139-F155 HydrophobicContact CG1-CE1 4.23Å; I139-F155 HydrophobicContact CG1-CE2 4.5Å; I139-F155 HydrophobicContact CG1-CZ 3.96Å; I139-F155 HydrophobicContact CG2-CE2 4.45Å; I139-F155 HydrophobicContact CG2-CZ 4.24Å; I151-F155 HydrophobicContact CG2-CD2 3.97Å; I151-F155 HydrophobicContact CG2-CE2 4.39Å; I151-F155 WeakPolarHBondContact O-CB 3.45Å; I151-F155 WeakPolarHBondContact O-CD2 3.38Å; I151-F155 PolarHBondContact O-N 2.7Å; V153-F155 VanDerWaalsContact C-N 3.33Å; V153-F155 PolarHBondContact O-N 3.45Å; F155-S157 PolarHBondContact O-N 3.49Å; F155-F158 PolarHBondContact O-N 2.73Å; F155-F158 VanDerWaalsContact O-N 3.11Å; F155-I161 HydrophobicContact CB-CD1 3.69Å; F155-F182 HydrophobicContact CB-CZ 4.11Å; F155-F182 HydrophobicContact CD1-CE2 4.38Å; F155-F182 HydrophobicContact CD1-CZ 4.14Å; F155-A191 HydrophobicContact CD1-CB 4.16Å; F155-A191 HydrophobicContact CE1-CB 4.43Å; F155-M195 HydrophobicContact CE1-CB 4Å; F155-M195 HydrophobicContact CE1-CG 4.12Å; F155-M195 HydrophobicContact CZ-CB 3.95Å; F155-M195 HydrophobicContact CZ-CG 4.22Å; F155-M208 HydrophobicContact CE2-CE 3.94Å; F155-M208 HydrophobicContact CE2-SD 4.08Å; F155-M208 HydrophobicContact CZ-CE 3.72Å; F155-M208 HydrophobicContact CZ-SD 4.08Å; F155-V210 HydrophobicContact CE1-CG1 4.06Å; F155-V210 HydrophobicContact CE1-CG2 4.02Å; F155-V210 HydrophobicContact CZ-CG2 3.72Å
156	S	91	Very high	89	Confident	70 Å²	70	62 Å²	62	49%	0.49	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-22.4	179.9	-171.2	0	0	0	0	113.4	R152 V153 F158 G159	R152-S156 WeakPolarHBondContact O-CB 3.12Å; R152-S156 PolarHBondContact O-N 3.19Å; V153-S156 PolarHBondContact O-N 2.96Å; S156-F158 PolarHBondContact O-N 3.21Å; S156-G159 WeakPolarHBondContact CA-O 3.48Å; S156-G159 PolarHBondContact O-N 2.79Å
157	S	90.5	Very high	89.3	Confident	100 Å²	100	64.6 Å²	64.6	70%	0.699	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.5	175.2	-54	0	0	0	0	113.6	F155	F155-S157 PolarHBondContact O-N 3.49Å
158	F	88.6	Confident	89.3	Confident	53 Å²	53	68 Å²	68	23%	0.232	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-6.1	-177.3	-51.1	-72.4	0	0	0	113.4	M154 F155 S156 M187 T190 A191 A194 M195	M154-F158 WeakPolarHBondContact O-CE2 3.43Å; F155-F158 PolarHBondContact O-N 2.73Å; F155-F158 VanDerWaalsContact O-N 3.11Å; S156-F158 PolarHBondContact O-N 3.21Å; F158-M187 WeakPolarHBondContact O-CB 3Å; F158-T190 HydrophobicContact CD1-CG2 4.38Å; F158-A191 HydrophobicContact CB-CB 3.86Å; F158-A191 HydrophobicContact CD2-CB 4.5Å; F158-A191 HydrophobicContact CG-CB 4.3Å; F158-A194 HydrophobicContact CD1-CB 3.83Å; F158-A194 HydrophobicContact CE1-CB 3.37Å; F158-A194 HydrophobicContact CZ-CB 3.96Å; F158-M195 HydrophobicContact CD2-CG 3.95Å; F158-M195 HydrophobicContact CE2-CG 3.33Å; F158-M195 HydrophobicContact CE2-SD 3.43Å; F158-M195 WeakPolarHBondContact CE2-SD 3.43Å; F158-M195 HydrophobicContact CZ-CG 3.71Å; F158-M195 HydrophobicContact CZ-SD 3.45Å; F158-M195 WeakPolarHBondContact CZ-SD 3.04Å
159	G	88.3	Confident	89.1	Confident	13 Å²	13	65.8 Å²	65.8	13%	0.134	33%	0.333	C	S	.	.	S	Bend	trans	156.9	172.5	178.4	0	0	0	0	0	114	S156 F182 M187	S156-G159 WeakPolarHBondContact CA-O 3.48Å; S156-G159 PolarHBondContact O-N 2.79Å; G159-F182 WeakPolarHBondContact O-CE1 3.47Å; G159-M187 VanDerWaalsContact CA-SD 3.59Å
160	Q	91.1	Very high	88.7	Confident	137 Å²	137	67.5 Å²	67.5	64%	0.64	35%	0.349	S	S	*	.			trans	-79.5	129.8	-179.5	-165	175.9	28.3	0	0	111	F182 T183	Q160-F182 WeakPolarHBondContact O-CA 3.43Å; Q160-F182 WeakPolarHBondContact O-CD1 3.31Å; Q160-T183 HydrophobicContact CB-CG2 3.92Å; Q160-T183 HydrophobicContact CG-CG2 4.05Å; Q160-T183 PolarHBondContact O-N 3.5Å; Q160-T183 PolarHBondContact O-OG1 3.35Å
161	I	91.3	Very high	88.4	Confident	11 Å²	11	68.9 Å²	68.9	6%	0.056	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.3	-176.1	-62.8	166	0	0	0	109.7	R152 F155 E163 C164 V180 F182	R152-I161 HydrophobicContact CG-CD1 4.27Å; R152-I161 PolarHBondContact NH1-O 2.93Å; F155-I161 HydrophobicContact CB-CD1 3.69Å; I161-E163 VanDerWaalsContact CG2-O 3.3Å; I161-E163 WeakPolarHBondContact CG2-O 3.5Å; I161-C164 HydrophobicContact CG2-CB 4.24Å; I161-V180 HydrophobicContact CD1-CG1 4.12Å; I161-V180 HydrophobicContact CG1-CG1 3.94Å; I161-V180 HydrophobicContact CG2-CG1 3.93Å; I161-F182 HydrophobicContact CG1-CD1 4.13Å; I161-F182 HydrophobicContact CG1-CE1 3.81Å; I161-F182 HydrophobicContact CG1-CZ 4.23Å
162	E	87.7	Confident	87.8	Confident	108 Å²	108	70.7 Å²	70.7	51%	0.505	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	-71.9	167.1	-67.1	-168.2	95.1	0	0	109.3	R135 R152 T181 T183	R135-E162 IonicContact CZ-OE2 3.95Å; R135-E162 IonicContact NH1-OE2 2.73Å; R135-E162 PolarHBondContact NH1-OE2 3.49Å; R135-E162 IonicContact NH2-OE2 3.93Å; R135-E162 PolarHBondContact NH2-OE2 2.93Å; R152-E162 PolarHBondContact NH2-O 3.36Å; E162-T181 PolarHBondContact N-O 2.9Å; E162-T183 HydrophobicContact CG-CG2 3.9Å
163	E	85.6	Confident	87.4	Confident	66 Å²	66	71 Å²	71	31%	0.308	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.3	-173.6	-166.9	-163	158.6	0	0	110.6	K136 I161 V180 T181	K136-E163 IonicContact NZ-OE1 3.26Å; K136-E163 PolarHBondContact NZ-OE1 2.84Å; K136-E163 IonicContact NZ-OE2 2.84Å; K136-E163 PolarHBondContact NZ-OE2 2.62Å; I161-E163 VanDerWaalsContact CG2-O 3.3Å; I161-E163 WeakPolarHBondContact CG2-O 3.5Å; E163-V180 CarbonylContact O-C 3.5Å; E163-V180 WeakPolarHBondContact O-CA 3.37Å; E163-T181 PolarHBondContact O-N 2.91Å; E163-T181 PolarHBondContact OE2-OG1 3.24Å
164	C	90	Very high	87.2	Confident	18 Å²	18	66.8 Å²	66.8	12%	0.122	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	130.8	163.9	179.4	0	0	0	0	108	I161 F179 V180	I161-C164 HydrophobicContact CG2-CB 4.24Å; C164-F179 WeakPolarHBondContact CA-O 3.42Å; C164-V180 HydrophobicContact CB-CG2 4.18Å
165	R	89.9	Confident	87	Confident	163 Å²	163	72.2 Å²	72.2	62%	0.615	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.6	121.7	-174.3	-173.8	176.1	-175	171.6	3.1	111.4	A178 F179	R165-A178 CarbonylContact O-C 3.59Å; R165-A178 WeakPolarHBondContact O-CA 3.33Å; R165-F179 PolarHBondContact N-O 3.09Å; R165-F179 PolarHBondContact O-N 2.7Å
166	I	90.9	Very high	86.9	Confident	8 Å²	8	72.7 Å²	72.7	4%	0.041	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	139.3	174.5	-66.1	-179.6	0	0	0	110.2	C146 T147 E148 I151 R168 S174 A178	C146-I166 WeakPolarHBondContact O-CD1 3.46Å; T147-I166 VanDerWaalsContact C-CD1 3.42Å; E148-I166 HydrophobicContact CG-CD1 4.47Å; E148-I166 HydrophobicContact CG-CG1 4.06Å; E148-I166 VanDerWaalsContact OE1-CB 3.29Å; E148-I166 WeakPolarHBondContact OE1-CB 3.45Å; E148-I166 PolarHBondContact OE1-N 3.32Å; E148-I166 VanDerWaalsContact OE1-N 3.09Å; I151-I166 HydrophobicContact CD1-CD1 3.78Å; I151-I166 HydrophobicContact CD1-CG1 3.65Å; I166-R168 HydrophobicContact CG2-CG 4.14Å; I166-R168 PolarHBondContact O-N 2.87Å; I166-S174 WeakPolarHBondContact CG2-OG 3.35Å; I166-A178 HydrophobicContact CG1-CB 4.08Å
167	L	88.4	Confident	86.8	Confident	73 Å²	73	70 Å²	70	38%	0.382	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	103.9	174.1	-157.4	69.4	0	0	0	109.1	R175 C177 F179	L167-R175 VanDerWaalsContact O-CB 3.27Å; L167-R175 WeakPolarHBondContact O-CB 3.27Å; L167-R175 WeakPolarHBondContact O-CG 3.43Å; L167-R175 PolarHBondContact O-N 2.91Å; L167-C177 PolarHBondContact N-O 3.09Å; L167-F179 HydrophobicContact CD1-CE2 4.26Å; L167-F179 HydrophobicContact CD2-CE2 4.47Å
168	R	89.4	Confident	86.9	Confident	128 Å²	128	65.3 Å²	65.3	48%	0.483	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	150.9	178.3	-61.7	173.1	-167.8	-101.2	-1.9	110.2	E148 I166 L173	E148-R168 IonicContact OE1-NE 3.31Å; E148-R168 IonicContact OE1-NH2 3.9Å; E148-R168 PolarHBondContact OE1-NH2 2.81Å; E148-R168 IonicContact OE2-NH2 3.37Å; E148-R168 PolarHBondContact OE2-NH2 3.07Å; I166-R168 HydrophobicContact CG2-CG 4.14Å; I166-R168 PolarHBondContact O-N 2.87Å; R168-L173 CarbonylContact C-O 3.44Å; R168-L173 VanDerWaalsContact CA-O 3.26Å; R168-L173 WeakPolarHBondContact CA-O 3.44Å
169	G	84.3	Confident	87.1	Confident	13 Å²	13	65.3 Å²	65.3	13%	0.134	33%	0.331	C	S	.	.			trans	-83.1	179	176.9	0	0	0	0	0	112.6	D171 G172 L173	G169-D171 WeakPolarHBondContact CA-OD1 3.46Å; G169-D171 PolarHBondContact O-N 3.48Å; G169-G172 PolarHBondContact O-N 2.76Å; G169-L173 PolarHBondContact N-O 3.4Å
170	P	82.1	Confident	87.3	Confident	136 Å²	136	64.7 Å²	64.7	88%	0.883	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-18.7	174.6	30.8	-35.7	0	0	0	112.5	G172	P170-G172 VanDerWaalsContact C-N 3.29Å
171	D	81.6	Confident	87.3	Confident	105 Å²	105	58.3 Å²	58.3	56%	0.561	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	0.2	170	57.6	-24.5	0	0	0	113.6	G169 L173	G169-D171 WeakPolarHBondContact CA-OD1 3.46Å; G169-D171 PolarHBondContact O-N 3.48Å; D171-L173 HydrophobicContact CB-CG 4.48Å; D171-L173 PolarHBondContact O-N 2.78Å; D171-L173 WeakPolarHBondContact OD2-CD1 3.31Å
172	G	77.1	Confident	87.3	Confident	44 Å²	44	57.8 Å²	57.8	45%	0.454	29%	0.292	S	S	.	.	S	Bend	trans	73.5	-15	-178.4	0	0	0	0	0	115.2	G169 P170	G169-G172 PolarHBondContact O-N 2.76Å; P170-G172 VanDerWaalsContact C-N 3.29Å
173	L	81.4	Confident	87.3	Confident	101 Å²	101	54.8 Å²	54.8	53%	0.529	28%	0.282	S	S	.	.	S	Bend	trans	-67.5	148.9	177.3	-58.7	-176.4	0	0	0	111.5	R168 G169 D171 R175	R168-L173 CarbonylContact C-O 3.44Å; R168-L173 VanDerWaalsContact CA-O 3.26Å; R168-L173 WeakPolarHBondContact CA-O 3.44Å; G169-L173 PolarHBondContact N-O 3.4Å; D171-L173 HydrophobicContact CB-CG 4.48Å; D171-L173 PolarHBondContact O-N 2.78Å; D171-L173 WeakPolarHBondContact OD2-CD1 3.31Å; L173-R175 PolarHBondContact O-N 2.73Å
174	S	85.5	Confident	87.4	Confident	8 Å²	8	54.2 Å²	54.2	6%	0.056	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	130.8	171.2	175.4	0	0	0	0	110.3	K144 I166 G176	K144-S174 WeakPolarHBondContact CG-O 3.4Å; K144-S174 WeakPolarHBondContact O-CB 3.38Å; I166-S174 WeakPolarHBondContact CG2-OG 3.35Å; S174-G176 PolarHBondContact O-N 2.8Å; S174-G176 PolarHBondContact OG-N 3.35Å
175	R	84	Confident	87.2	Confident	161 Å²	161	58.4 Å²	58.4	61%	0.608	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	3.1	175.2	-63.2	-174.7	65.2	93.2	3.8	113.2	L167 L173 C177	L167-R175 VanDerWaalsContact O-CB 3.27Å; L167-R175 WeakPolarHBondContact O-CB 3.27Å; L167-R175 WeakPolarHBondContact O-CG 3.43Å; L167-R175 PolarHBondContact O-N 2.91Å; L173-R175 PolarHBondContact O-N 2.73Å; R175-C177 VanDerWaalsContact C-N 3.33Å
176	G	86.1	Confident	87.2	Confident	10 Å²	10	53.6 Å²	53.6	10%	0.103	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72.7	26.9	-171.7	0	0	0	0	0	112.9	G140 M141 I142 S174	G140-G176 CarbonylContact C-O 3.58Å; M141-G176 PolarHBondContact N-O 2.83Å; I142-G176 WeakPolarHBondContact CG1-O 3.33Å; I142-G176 PolarHBondContact N-O 2.91Å; I142-G176 VanDerWaalsContact N-O 3.08Å; I142-G176 WeakPolarHBondContact O-CA 3.22Å; S174-G176 PolarHBondContact O-N 2.8Å; S174-G176 PolarHBondContact OG-N 3.35Å
177	C	89.9	Confident	87.2	Confident	15 Å²	15	56 Å²	56	10%	0.101	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	157.2	173.3	60.6	0	0	0	0	113.4	F138 I139 L167 R175	F138-C177 HydrophobicContact CE2-CB 3.58Å; F138-C177 HydrophobicContact CZ-CB 3.56Å; I139-C177 CarbonylContact O-C 3.59Å; I139-C177 WeakPolarHBondContact O-CA 3.45Å; I139-C177 VanDerWaalsContact O-CB 3.32Å; I139-C177 WeakPolarHBondContact O-CB 3.38Å; L167-C177 PolarHBondContact N-O 3.09Å; R175-C177 VanDerWaalsContact C-N 3.33Å
178	A	92.1	Very high	87.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	166.8	-176.9	0	0	0	0	0	111.6	I139 I142 I151 R165 I166	I139-A178 PolarHBondContact N-O 3.29Å; I139-A178 PolarHBondContact O-N 3.08Å; I142-A178 HydrophobicContact CD1-CB 3.93Å; I151-A178 HydrophobicContact CD1-CB 3.59Å; R165-A178 CarbonylContact O-C 3.59Å; R165-A178 WeakPolarHBondContact O-CA 3.33Å; I166-A178 HydrophobicContact CG1-CB 4.08Å
179	F	93.1	Very high	87.3	Confident	54 Å²	54	50.5 Å²	50.5	24%	0.237	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	141.3	166.7	-67.2	-79.1	0	0	0	110.8	K136 L137 F138 C164 R165 L167 A213	K136-F179 HydrophobicContact CG-CB 4.48Å; K136-F179 HydrophobicContact CG-CD1 4.33Å; L137-F179 VanDerWaalsContact O-CA 3.28Å; L137-F179 WeakPolarHBondContact O-CA 3.3Å; F138-F179 HydrophobicContact CB-CD1 4.24Å; F138-F179 HydrophobicContact CB-CE1 3.98Å; F138-F179 HydrophobicContact CD2-CD1 4.3Å; F138-F179 AromaticContact CD2-CE1 3.75Å; F138-F179 HydrophobicContact CD2-CE1 3.75Å; F138-F179 AromaticContact CD2-CZ 3.9Å; F138-F179 HydrophobicContact CD2-CZ 3.9Å; F138-F179 HydrophobicContact CG-CE1 4.36Å; C164-F179 WeakPolarHBondContact CA-O 3.42Å; R165-F179 PolarHBondContact N-O 3.09Å; R165-F179 PolarHBondContact O-N 2.7Å; L167-F179 HydrophobicContact CD1-CE2 4.26Å; L167-F179 HydrophobicContact CD2-CE2 4.47Å; F179-A213 HydrophobicContact CD1-CB 3.98Å; F179-A213 HydrophobicContact CE1-CB 3.76Å
180	V	92.7	Very high	87.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.6	175.7	167.3	0	0	0	0	109.2	L137 I139 I151 I161 E163 C164 F182	L137-V180 PolarHBondContact N-O 3.43Å; L137-V180 PolarHBondContact O-N 3.09Å; I139-V180 HydrophobicContact CD1-CB 3.93Å; I139-V180 HydrophobicContact CD1-CG2 3.49Å; I139-V180 VanDerWaalsContact CD1-CG2 3.49Å; I151-V180 HydrophobicContact CG2-CG2 3.71Å; I161-V180 HydrophobicContact CD1-CG1 4.12Å; I161-V180 HydrophobicContact CG1-CG1 3.94Å; I161-V180 HydrophobicContact CG2-CG1 3.93Å; E163-V180 CarbonylContact O-C 3.5Å; E163-V180 WeakPolarHBondContact O-CA 3.37Å; C164-V180 HydrophobicContact CB-CG2 4.18Å; V180-F182 HydrophobicContact CG1-CD2 4.04Å; V180-F182 HydrophobicContact CG1-CE2 3.7Å; V180-F182 HydrophobicContact CG1-CZ 4.19Å
181	T	90.1	Very high	88.1	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.7	177.2	-50.9	0	0	0	0	109.2	V132 R135 E162 E163	V132-T181 HydrophobicContact CG1-CG2 4.1Å; R135-T181 HydrophobicContact CB-CG2 4.41Å; E162-T181 PolarHBondContact N-O 2.9Å; E163-T181 PolarHBondContact O-N 2.91Å; E163-T181 PolarHBondContact OE2-OG1 3.24Å
182	F	91.4	Very high	88.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	154.4	176.2	-78.2	-85.9	0	0	0	112	R135 L137 F155 G159 Q160 I161 V180 T184 M187 A188 A191	R135-F182 WeakPolarHBondContact CB-O 3.4Å; R135-F182 WeakPolarHBondContact CD-O 3.34Å; R135-F182 PolarHBondContact NH1-O 3.07Å; R135-F182 PolarHBondContact O-N 2.92Å; R135-F182 VanDerWaalsContact O-N 3.14Å; L137-F182 HydrophobicContact CD1-CD2 4.14Å; L137-F182 HydrophobicContact CD1-CE2 3.73Å; L137-F182 HydrophobicContact CG-CD2 4.37Å; L137-F182 HydrophobicContact CG-CE2 4.38Å; F155-F182 HydrophobicContact CB-CZ 4.11Å; F155-F182 HydrophobicContact CD1-CE2 4.38Å; F155-F182 HydrophobicContact CD1-CZ 4.14Å; G159-F182 WeakPolarHBondContact O-CE1 3.47Å; Q160-F182 WeakPolarHBondContact O-CA 3.43Å; Q160-F182 WeakPolarHBondContact O-CD1 3.31Å; I161-F182 HydrophobicContact CG1-CD1 4.13Å; I161-F182 HydrophobicContact CG1-CE1 3.81Å; I161-F182 HydrophobicContact CG1-CZ 4.23Å; V180-F182 HydrophobicContact CG1-CD2 4.04Å; V180-F182 HydrophobicContact CG1-CE2 3.7Å; V180-F182 HydrophobicContact CG1-CZ 4.19Å; F182-T184 PolarHBondContact O-N 3.44Å; F182-M187 HydrophobicContact CB-CB 4.16Å; F182-M187 HydrophobicContact CD1-CB 3.78Å; F182-M187 HydrophobicContact CE1-CB 4.45Å; F182-M187 HydrophobicContact CG-CB 4.11Å; F182-A188 HydrophobicContact CB-CB 4.28Å; F182-A188 HydrophobicContact CD2-CB 3.95Å; F182-A188 HydrophobicContact CG-CB 4.4Å; F182-A191 HydrophobicContact CE2-CB 3.73Å; F182-A191 HydrophobicContact CZ-CB 3.68Å
183	T	88.3	Confident	89.2	Confident	45 Å²	45	49.5 Å²	49.5	28%	0.276	25%	0.249	S	C	.	.	S	Bend	trans	-62.6	-27.9	173.4	54.6	0	0	0	0	113	R135 Q160 E162 M187	R135-T183 WeakPolarHBondContact CD-O 3.35Å; R135-T183 PolarHBondContact NH1-O 2.91Å; Q160-T183 HydrophobicContact CB-CG2 3.92Å; Q160-T183 HydrophobicContact CG-CG2 4.05Å; Q160-T183 PolarHBondContact O-N 3.5Å; Q160-T183 PolarHBondContact O-OG1 3.35Å; E162-T183 HydrophobicContact CG-CG2 3.9Å; T183-M187 PolarHBondContact OG1-SD 3.03Å
184	T	86.3	Confident	89.5	Confident	54 Å²	54	46.6 Å²	46.6	33%	0.331	24%	0.239	S	C	.	.	S	Bend	trans	-132.9	152	177.7	74.2	0	0	0	0	113.2	F182 A186 M187 A188	F182-T184 PolarHBondContact O-N 3.44Å; T184-A186 VanDerWaalsContact C-N 3.31Å; T184-A186 PolarHBondContact O-N 2.82Å; T184-M187 HydrophobicContact CG2-CE 4.25Å; T184-M187 HydrophobicContact CG2-SD 4.22Å; T184-M187 PolarHBondContact O-N 2.92Å; T184-M187 WeakPolarHBondContact OG1-CB 3.2Å; T184-M187 WeakPolarHBondContact OG1-CG 3.38Å; T184-M187 PolarHBondContact OG1-N 3.48Å; T184-M187 PolarHBondContact OG1-SD 2.76Å; T184-A188 PolarHBondContact O-N 3.42Å
185	R	86.9	Confident	89.5	Confident	105 Å²	105	47 Å²	47	40%	0.396	24%	0.24	S	C	.	.	H	α-helix	trans	-65.6	-33.1	175.2	-172.5	177.1	-162.1	150.9	20.4	112.4	D134 R135 A188 Q189	D134-R185 IonicContact OD1-CZ 2.67Å; D134-R185 VanDerWaalsContact OD1-CZ 3.31Å; D134-R185 IonicContact OD1-NH1 3.12Å; D134-R185 IonicContact OD1-NH2 3.52Å; D134-R185 PolarHBondContact OD1-NH2 2.58Å; D134-R185 IonicContact OD2-CZ 3.39Å; D134-R185 VanDerWaalsContact OD2-CZ 3.26Å; D134-R185 IonicContact OD2-NH1 2.91Å; D134-R185 PolarHBondContact OD2-NH1 3.16Å; D134-R185 IonicContact OD2-NH2 2.66Å; D134-R185 PolarHBondContact OD2-NH2 3.38Å; R135-R185 HydrophobicContact CG-CB 4.3Å; R185-A188 WeakPolarHBondContact O-CB 3.37Å; R185-A188 PolarHBondContact O-N 3Å; R185-Q189 WeakPolarHBondContact O-CG 3.13Å; R185-Q189 PolarHBondContact O-N 3.41Å
186	A	89.1	Confident	89.7	Confident	62 Å²	62	42 Å²	42	51%	0.512	22%	0.223	S	C	.	.	H	α-helix	trans	-63.2	-45.4	177.8	0	0	0	0	0	111.6	T184 A188 Q189 T190	T184-A186 VanDerWaalsContact C-N 3.31Å; T184-A186 PolarHBondContact O-N 2.82Å; A186-A188 VanDerWaalsContact C-N 3.34Å; A186-A188 PolarHBondContact O-N 2.8Å; A186-Q189 PolarHBondContact O-N 2.88Å; A186-T190 PolarHBondContact O-N 3.31Å; A186-T190 PolarHBondContact O-OG1 3.38Å
187	M	90.9	Very high	89.6	Confident	59 Å²	59	47.3 Å²	47.3	29%	0.291	25%	0.246	S	C	.	.	H	α-helix	trans	-59.1	-44.3	173.4	-69.9	164.1	-173.2	0	0	111.7	F158 G159 F182 T183 T184 Q189 T190 A191	F158-M187 WeakPolarHBondContact O-CB 3Å; G159-M187 VanDerWaalsContact CA-SD 3.59Å; F182-M187 HydrophobicContact CB-CB 4.16Å; F182-M187 HydrophobicContact CD1-CB 3.78Å; F182-M187 HydrophobicContact CE1-CB 4.45Å; F182-M187 HydrophobicContact CG-CB 4.11Å; T183-M187 PolarHBondContact OG1-SD 3.03Å; T184-M187 HydrophobicContact CG2-CE 4.25Å; T184-M187 HydrophobicContact CG2-SD 4.22Å; T184-M187 PolarHBondContact O-N 2.92Å; T184-M187 WeakPolarHBondContact OG1-CB 3.2Å; T184-M187 WeakPolarHBondContact OG1-CG 3.38Å; T184-M187 PolarHBondContact OG1-N 3.48Å; T184-M187 PolarHBondContact OG1-SD 2.76Å; M187-Q189 VanDerWaalsContact C-N 3.34Å; M187-Q189 PolarHBondContact O-N 3.05Å; M187-T190 PolarHBondContact O-N 2.75Å; M187-A191 WeakPolarHBondContact O-CB 3.37Å; M187-A191 PolarHBondContact O-N 2.67Å
188	A	90	Very high	89	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-40.4	175.8	0	0	0	0	0	112.7	L137 F182 T184 R185 A186 A191 I192 F212	L137-A188 HydrophobicContact CD1-CB 4.4Å; L137-A188 HydrophobicContact CD2-CB 3.95Å; L137-A188 HydrophobicContact CG-CB 4.17Å; F182-A188 HydrophobicContact CB-CB 4.28Å; F182-A188 HydrophobicContact CD2-CB 3.95Å; F182-A188 HydrophobicContact CG-CB 4.4Å; T184-A188 PolarHBondContact O-N 3.42Å; R185-A188 WeakPolarHBondContact O-CB 3.37Å; R185-A188 PolarHBondContact O-N 3Å; A186-A188 VanDerWaalsContact C-N 3.34Å; A186-A188 PolarHBondContact O-N 2.8Å; A188-A191 PolarHBondContact O-N 3.49Å; A188-I192 WeakPolarHBondContact O-CG1 3.22Å; A188-I192 PolarHBondContact O-N 2.85Å; A188-F212 HydrophobicContact CB-CE1 4.23Å
189	Q	90.8	Very high	87.9	Confident	85 Å²	85	53.8 Å²	53.8	40%	0.397	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-41.9	174.3	-73	-179.6	-10.9	0	0	112.7	R185 A186 M187 I192 K193 F212	R185-Q189 WeakPolarHBondContact O-CG 3.13Å; R185-Q189 PolarHBondContact O-N 3.41Å; A186-Q189 PolarHBondContact O-N 2.88Å; M187-Q189 VanDerWaalsContact C-N 3.34Å; M187-Q189 PolarHBondContact O-N 3.05Å; Q189-I192 PolarHBondContact O-N 3.39Å; Q189-K193 WeakPolarHBondContact O-CG 3.35Å; Q189-K193 PolarHBondContact O-N 3.37Å; Q189-F212 HydrophobicContact CG-CE2 4.35Å; Q189-F212 HydrophobicContact CG-CZ 3.78Å
190	T	91.4	Very high	87	Confident	73 Å²	73	55.1 Å²	55.1	45%	0.448	30%	0.299	S	S	.	.	H	α-helix	trans	-63.5	-43.4	175.7	-61.2	0	0	0	0	111.1	F158 A186 M187 I192 K193 A194	F158-T190 HydrophobicContact CD1-CG2 4.38Å; A186-T190 PolarHBondContact O-N 3.31Å; A186-T190 PolarHBondContact O-OG1 3.38Å; M187-T190 PolarHBondContact O-N 2.75Å; T190-I192 PolarHBondContact O-N 3.43Å; T190-K193 PolarHBondContact O-N 3.16Å; T190-A194 WeakPolarHBondContact O-CB 3.47Å; T190-A194 PolarHBondContact O-N 2.82Å
191	A	91	Very high	85.8	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.8	-40.3	175.2	0	0	0	0	0	112.7	L137 F155 F158 F182 M187 A188 M195	L137-A191 HydrophobicContact CD1-CB 3.95Å; F155-A191 HydrophobicContact CD1-CB 4.16Å; F155-A191 HydrophobicContact CE1-CB 4.43Å; F158-A191 HydrophobicContact CB-CB 3.86Å; F158-A191 HydrophobicContact CD2-CB 4.5Å; F158-A191 HydrophobicContact CG-CB 4.3Å; F182-A191 HydrophobicContact CE2-CB 3.73Å; F182-A191 HydrophobicContact CZ-CB 3.68Å; M187-A191 WeakPolarHBondContact O-CB 3.37Å; M187-A191 PolarHBondContact O-N 2.67Å; A188-A191 PolarHBondContact O-N 3.49Å; A191-M195 VanDerWaalsContact O-CB 3.29Å; A191-M195 WeakPolarHBondContact O-CB 3.23Å; A191-M195 PolarHBondContact O-N 2.87Å
192	I	92	Very high	84.4	Confident	32 Å²	32	65.5 Å²	65.5	16%	0.164	35%	0.348	C	S	.	.	H	α-helix	trans	-59.6	-53.3	170.5	-67	162.8	0	0	0	110	L137 A188 Q189 T190 A194 H196 V210 F212	L137-I192 HydrophobicContact CD1-CG1 4.08Å; L137-I192 HydrophobicContact CD2-CD1 3.6Å; L137-I192 HydrophobicContact CD2-CG1 3.73Å; A188-I192 WeakPolarHBondContact O-CG1 3.22Å; A188-I192 PolarHBondContact O-N 2.85Å; Q189-I192 PolarHBondContact O-N 3.39Å; T190-I192 PolarHBondContact O-N 3.43Å; I192-A194 VanDerWaalsContact C-N 3.28Å; I192-A194 PolarHBondContact O-N 3.29Å; I192-H196 HydrophobicContact CG2-CB 4.31Å; I192-H196 WeakPolarHBondContact O-CB 3.49Å; I192-H196 PolarHBondContact O-N 2.84Å; I192-V210 HydrophobicContact CG1-CG1 4Å; I192-F212 HydrophobicContact CD1-CD1 4.38Å; I192-F212 HydrophobicContact CD1-CD2 3.55Å; I192-F212 HydrophobicContact CD1-CE1 4.25Å; I192-F212 HydrophobicContact CD1-CE2 3.39Å; I192-F212 HydrophobicContact CD1-CG 4.05Å; I192-F212 HydrophobicContact CD1-CZ 3.77Å
193	K	90.1	Very high	83	Confident	173 Å²	173	69.6 Å²	69.6	75%	0.752	39%	0.39	S	S	*	.	H	α-helix	trans	-60.1	-35.1	-175.9	-73	172.9	-179.4	178.3	0	113.4	Q189 T190	Q189-K193 WeakPolarHBondContact O-CG 3.35Å; Q189-K193 PolarHBondContact O-N 3.37Å; T190-K193 PolarHBondContact O-N 3.16Å
194	A	88.1	Confident	81.9	Confident	40 Å²	40	68.8 Å²	68.8	33%	0.331	39%	0.386	S	S	.	.	H	α-helix	trans	-90.6	-31.1	-176.5	0	0	0	0	0	114.2	F158 T190 I192 A198	F158-A194 HydrophobicContact CD1-CB 3.83Å; F158-A194 HydrophobicContact CE1-CB 3.37Å; F158-A194 HydrophobicContact CZ-CB 3.96Å; T190-A194 WeakPolarHBondContact O-CB 3.47Å; T190-A194 PolarHBondContact O-N 2.82Å; I192-A194 VanDerWaalsContact C-N 3.28Å; I192-A194 PolarHBondContact O-N 3.29Å; A194-A198 WeakPolarHBondContact O-CB 3.19Å
195	M	86.1	Confident	80.9	Confident	16 Å²	16	72.3 Å²	72.3	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-111.6	-11.3	-172.8	-61.3	-58.2	-64.6	0	0	114.6	M154 F155 F158 A191 Q197 M208 V210	M154-M195 HydrophobicContact CG-CE 3.66Å; M154-M195 HydrophobicContact SD-CE 3.7Å; F155-M195 HydrophobicContact CE1-CB 4Å; F155-M195 HydrophobicContact CE1-CG 4.12Å; F155-M195 HydrophobicContact CZ-CB 3.95Å; F155-M195 HydrophobicContact CZ-CG 4.22Å; F158-M195 HydrophobicContact CD2-CG 3.95Å; F158-M195 HydrophobicContact CE2-CG 3.33Å; F158-M195 HydrophobicContact CE2-SD 3.43Å; F158-M195 WeakPolarHBondContact CE2-SD 3.43Å; F158-M195 HydrophobicContact CZ-CG 3.71Å; F158-M195 HydrophobicContact CZ-SD 3.45Å; F158-M195 WeakPolarHBondContact CZ-SD 3.04Å; A191-M195 VanDerWaalsContact O-CB 3.29Å; A191-M195 WeakPolarHBondContact O-CB 3.23Å; A191-M195 PolarHBondContact O-N 2.87Å; M195-Q197 PolarHBondContact O-N 3.25Å; M195-M208 HydrophobicContact CB-CE 3.9Å; M195-M208 HydrophobicContact CE-CE 3.54Å; M195-V210 HydrophobicContact CB-CG2 3.89Å
196	H	87.4	Confident	80.5	Confident	55 Å²	55	70 Å²	70	26%	0.255	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	120	173.9	-173	84.1	0	0	0	110.5	I192 A198 V210	I192-H196 HydrophobicContact CG2-CB 4.31Å; I192-H196 WeakPolarHBondContact O-CB 3.49Å; I192-H196 PolarHBondContact O-N 2.84Å; H196-A198 PolarHBondContact O-N 2.79Å; H196-V210 HydrophobicContact CB-CB 4.3Å; H196-V210 PolarHBondContact ND1-N 2.91Å; H196-V210 PolarHBondContact ND1-O 3.37Å
197	Q	83.2	Confident	80.2	Confident	123 Å²	123	69.2 Å²	69.2	58%	0.575	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	-1.9	-175.7	-60	174.3	48.3	0	0	116.1	M195 Q199 P207 M208	M195-Q197 PolarHBondContact O-N 3.25Å; Q197-Q199 PolarHBondContact O-N 2.74Å; Q197-P207 HydrophobicContact CB-CB 4.43Å; Q197-P207 HydrophobicContact CB-CG 4.31Å; Q197-P207 HydrophobicContact CG-CG 4.3Å; Q197-M208 WeakPolarHBondContact CA-O 3.16Å; Q197-M208 PolarHBondContact N-O 3.44Å
198	A	77.3	Confident	80.1	Confident	70 Å²	70	66.4 Å²	66.4	58%	0.579	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-23	-172.6	0	0	0	0	0	115	A194 H196	A194-A198 WeakPolarHBondContact O-CB 3.19Å; H196-A198 PolarHBondContact O-N 2.79Å
199	Q	69.6	Low	80	Confident	80 Å²	80	68.4 Å²	68.4	37%	0.374	40%	0.401	S	S	.	.			trans	-138.2	129.9	-178.7	-173	169	-8.8	0	0	111.5	Q197 M201 M208	Q197-Q199 PolarHBondContact O-N 2.74Å; Q199-M201 HydrophobicContact CG-SD 4.18Å; Q199-M201 PolarHBondContact NE2-SD 3.17Å; Q199-M201 VanDerWaalsContact NE2-SD 3.44Å; Q199-M208 WeakPolarHBondContact O-CB 3.39Å; Q199-M208 PolarHBondContact O-N 2.84Å
200	T	74.2	Confident	80.1	Confident	82 Å²	82	64.4 Å²	64.4	50%	0.503	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-97.4	121.4	166	-56.3	0	0	0	0	108	C204 P207	T200-C204 HydrophobicContact CG2-CB 4.5Å; T200-C204 WeakPolarHBondContact CG2-O 3.24Å; T200-P207 WeakPolarHBondContact OG1-CA 2.9Å; T200-P207 WeakPolarHBondContact OG1-CB 3.37Å
201	M	67.6	Low	80.1	Confident	41 Å²	41	66.6 Å²	66.6	20%	0.202	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-79.4	151.8	179.1	-65.6	-61.9	-73.8	0	0	111.5	M154 Q199 G203 C204	M154-M201 HydrophobicContact CE-CE 4.35Å; M154-M201 HydrophobicContact CE-SD 3.95Å; Q199-M201 HydrophobicContact CG-SD 4.18Å; Q199-M201 PolarHBondContact NE2-SD 3.17Å; Q199-M201 VanDerWaalsContact NE2-SD 3.44Å; M201-G203 PolarHBondContact O-N 3.08Å; M201-C204 WeakPolarHBondContact O-CB 3.34Å; M201-C204 PolarHBondContact O-N 3.24Å
202	E	61	Low	80.1	Confident	181 Å²	181	70.1 Å²	70.1	85%	0.846	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	126.6	176.2	-65.2	-169.4	152.6	0	0	111.7	S143	S143-E202 PolarHBondContact OG-O 3.04Å
203	G	62.5	Low	79.9	Confident	85 Å²	85	69.5 Å²	69.5	88%	0.876	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	6.8	-175.6	0	0	0	0	0	115.7	M201	M201-G203 PolarHBondContact O-N 3.08Å
204	C	64.1	Low	79.4	Confident	29 Å²	29	66.2 Å²	66.2	20%	0.196	39%	0.391	C	S	.	.			trans	-106	125.5	175.8	-66.4	0	0	0	0	112	T200 M201 S206	T200-C204 HydrophobicContact CG2-CB 4.5Å; T200-C204 WeakPolarHBondContact CG2-O 3.24Å; M201-C204 WeakPolarHBondContact O-CB 3.34Å; M201-C204 PolarHBondContact O-N 3.24Å; C204-S206 PolarHBondContact O-N 3.17Å
205	S	65.9	Low	78.9	Confident	128 Å²	128	65.5 Å²	65.5	90%	0.895	38%	0.382	S	S	*	.	S	Bend	trans	-77.4	7.3	177.3	-41.9	0	0	0	0	114.3
206	S	78.1	Confident	78	Confident	57 Å²	57	73 Å²	73	40%	0.399	42%	0.417	S	S	.	.	S	Bend	trans	-152.1	148.5	-178.7	-65.5	0	0	0	0	110.2	C204	C204-S206 PolarHBondContact O-N 3.17Å
207	P	83	Confident	77	Confident	44 Å²	44	77.4 Å²	77.4	29%	0.286	44%	0.436	S	S	.	.			trans	-70.2	158.4	178.7	32.4	-37.5	0	0	0	111.5	Q197 T200	Q197-P207 HydrophobicContact CB-CB 4.43Å; Q197-P207 HydrophobicContact CB-CG 4.31Å; Q197-P207 HydrophobicContact CG-CG 4.3Å; T200-P207 WeakPolarHBondContact OG1-CA 2.9Å; T200-P207 WeakPolarHBondContact OG1-CB 3.37Å
208	M	88.4	Confident	76.6	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.005	42%	0.424	C	S	.	.			trans	-62.5	134.8	-175.6	-174.7	173.5	58.2	0	0	112.7	I139 G140 I142 M154 F155 M195 Q197 Q199 V210	I139-M208 HydrophobicContact CG2-CG 3.81Å; I139-M208 HydrophobicContact CG2-SD 3.5Å; I139-M208 VanDerWaalsContact CG2-SD 3.5Å; G140-M208 WeakPolarHBondContact O-CG 3.44Å; I142-M208 HydrophobicContact CG2-CG 3.9Å; I142-M208 HydrophobicContact CG2-SD 3.53Å; I142-M208 VanDerWaalsContact CG2-SD 3.53Å; M154-M208 HydrophobicContact SD-CE 4.04Å; M154-M208 HydrophobicContact SD-SD 4.37Å; F155-M208 HydrophobicContact CE2-CE 3.94Å; F155-M208 HydrophobicContact CE2-SD 4.08Å; F155-M208 HydrophobicContact CZ-CE 3.72Å; F155-M208 HydrophobicContact CZ-SD 4.08Å; M195-M208 HydrophobicContact CB-CE 3.9Å; M195-M208 HydrophobicContact CE-CE 3.54Å; Q197-M208 WeakPolarHBondContact CA-O 3.16Å; Q197-M208 PolarHBondContact N-O 3.44Å; Q199-M208 WeakPolarHBondContact O-CB 3.39Å; Q199-M208 PolarHBondContact O-N 2.84Å; M208-V210 HydrophobicContact CE-CG2 3.99Å; M208-V210 HydrophobicContact CG-CG2 4.19Å; M208-V210 HydrophobicContact SD-CG2 4.39Å
209	V	89.3	Confident	76.6	Confident	42 Å²	42	78.5 Å²	78.5	26%	0.255	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	95.4	-175.2	-178.5	0	0	0	0	110.1	I139 G140 M141 K211	I139-V209 WeakPolarHBondContact CA-O 3.36Å; G140-V209 PolarHBondContact N-O 3.27Å; G140-V209 PolarHBondContact O-N 3.17Å; M141-V209 HydrophobicContact CB-CG2 4.41Å; M141-V209 HydrophobicContact CG-CG2 3.86Å; V209-K211 HydrophobicContact CG1-CG 4.38Å
210	V	91.9	Very high	76.9	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	120.9	175.9	-171.7	0	0	0	0	110.3	L137 F138 I139 F155 I192 M195 H196 M208	L137-V210 HydrophobicContact CB-CG1 4.49Å; L137-V210 HydrophobicContact CD1-CG1 3.71Å; F138-V210 WeakPolarHBondContact O-CA 3.18Å; I139-V210 HydrophobicContact CG1-CG1 4.39Å; I139-V210 HydrophobicContact CG1-CG2 4.47Å; I139-V210 HydrophobicContact CG2-CG2 4.45Å; F155-V210 HydrophobicContact CE1-CG1 4.06Å; F155-V210 HydrophobicContact CE1-CG2 4.02Å; F155-V210 HydrophobicContact CZ-CG2 3.72Å; I192-V210 HydrophobicContact CG1-CG1 4Å; M195-V210 HydrophobicContact CB-CG2 3.89Å; H196-V210 HydrophobicContact CB-CB 4.3Å; H196-V210 PolarHBondContact ND1-N 2.91Å; H196-V210 PolarHBondContact ND1-O 3.37Å; M208-V210 HydrophobicContact CE-CG2 3.99Å; M208-V210 HydrophobicContact CG-CG2 4.19Å; M208-V210 HydrophobicContact SD-CG2 4.39Å
211	K	90.9	Very high	77	Confident	119 Å²	119	83.8 Å²	83.8	52%	0.517	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	167.6	175.5	-66.8	-168.4	178.8	-172.4	0	110.2	L137 F138 V209	L137-K211 CarbonylContact C-O 3.57Å; L137-K211 WeakPolarHBondContact CA-O 3.3Å; F138-K211 PolarHBondContact N-O 3.25Å; F138-K211 PolarHBondContact O-N 2.6Å; V209-K211 HydrophobicContact CG1-CG 4.38Å
212	F	91.3	Very high	77.6	Confident	75 Å²	75	87 Å²	87	33%	0.329	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	146.2	162.4	-71.2	-73.6	0	0	0	110.3	D134 L137 A188 Q189 I192	D134-F212 WeakPolarHBondContact O-CE1 3.27Å; L137-F212 HydrophobicContact CD2-CD1 3.87Å; L137-F212 HydrophobicContact CD2-CE1 4.1Å; L137-F212 HydrophobicContact CD2-CG 4.36Å; A188-F212 HydrophobicContact CB-CE1 4.23Å; Q189-F212 HydrophobicContact CG-CE2 4.35Å; Q189-F212 HydrophobicContact CG-CZ 3.78Å; I192-F212 HydrophobicContact CD1-CD1 4.38Å; I192-F212 HydrophobicContact CD1-CD2 3.55Å; I192-F212 HydrophobicContact CD1-CE1 4.25Å; I192-F212 HydrophobicContact CD1-CE2 3.39Å; I192-F212 HydrophobicContact CD1-CG 4.05Å; I192-F212 HydrophobicContact CD1-CZ 3.77Å
213	A	87.2	Confident	78.5	Confident	18 Å²	18	87.1 Å²	87.1	15%	0.149	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-73.3	128.9	177	0	0	0	0	0	110.8	K136 F138 F179 T215	K136-A213 HydrophobicContact CB-CB 4.28Å; K136-A213 HydrophobicContact CG-CB 4.13Å; K136-A213 WeakPolarHBondContact O-CB 3.18Å; K136-A213 PolarHBondContact O-N 2.76Å; F138-A213 HydrophobicContact CB-CB 4.46Å; F179-A213 HydrophobicContact CD1-CB 3.98Å; F179-A213 HydrophobicContact CE1-CB 3.76Å; A213-T215 PolarHBondContact O-N 3.28Å
214	D	81.4	Confident	79.3	Confident	104 Å²	104	89.5 Å²	89.5	56%	0.556	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-57.3	127.5	168.1	-92.3	-35.1	0	0	0	109.9	K222	D214-K222 IonicContact OD1-NZ 3.68Å; D214-K222 PolarHBondContact OD1-NZ 3.29Å; D214-K222 IonicContact OD2-NZ 2.61Å; D214-K222 PolarHBondContact OD2-NZ 3.39Å; D214-K222 VanDerWaalsContact OD2-NZ 3.12Å
215	T	76.4	Confident	80	Confident	25 Å²	25	90.5 Å²	90.5	15%	0.153	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-68.9	162.3	173.7	79.3	0	0	0	0	110.4	E133 A213 K217 D218 K219	E133-T215 HydrophobicContact CB-CG2 4.28Å; E133-T215 HydrophobicContact CG-CG2 4.33Å; A213-T215 PolarHBondContact O-N 3.28Å; T215-K217 PolarHBondContact O-N 2.9Å; T215-K217 PolarHBondContact OG1-N 3.25Å; T215-D218 WeakPolarHBondContact CB-OD2 3.23Å; T215-D218 WeakPolarHBondContact CG2-OD2 3.42Å; T215-D218 PolarHBondContact O-N 3.24Å; T215-D218 PolarHBondContact OG1-N 3.25Å; T215-D218 PolarHBondContact OG1-OD2 3.03Å; T215-K219 PolarHBondContact O-N 3.19Å; T215-K219 VanDerWaalsContact O-N 3.1Å
216	Q	66.9	Low	80.7	Confident	174 Å²	174	90.4 Å²	90.4	81%	0.813	44%	0.439	S	S	*	.	H	α-helix	trans	-62.6	-30.9	173.2	-68.3	-169.3	77.3	0	0	111.8	K219 E220	Q216-K219 PolarHBondContact O-N 3.27Å; Q216-E220 WeakPolarHBondContact O-CB 3.41Å; Q216-E220 PolarHBondContact O-N 2.99Å
217	K	67.9	Low	80.8	Confident	147 Å²	147	93.9 Å²	93.9	64%	0.639	45%	0.449	S	S	*	.	H	α-helix	trans	-67.8	-46.1	175.6	-62.5	172.2	-176	163.8	0	111.4	T215 K219 E220 Q221	T215-K217 PolarHBondContact O-N 2.9Å; T215-K217 PolarHBondContact OG1-N 3.25Å; K217-K219 VanDerWaalsContact C-N 3.27Å; K217-K219 PolarHBondContact O-N 3.37Å; K217-E220 PolarHBondContact O-N 3.49Å; K217-Q221 VanDerWaalsContact O-CB 3.24Å; K217-Q221 WeakPolarHBondContact O-CB 3.47Å; K217-Q221 PolarHBondContact O-N 3.34Å
218	D	74.8	Confident	80.4	Confident	64 Å²	64	96.9 Å²	96.9	34%	0.342	46%	0.462	S	S	.	.	H	α-helix	trans	-56.8	-43.8	174.8	-74.1	-86	0	0	0	111.4	T215 Q221 K222	T215-D218 WeakPolarHBondContact CB-OD2 3.23Å; T215-D218 WeakPolarHBondContact CG2-OD2 3.42Å; T215-D218 PolarHBondContact O-N 3.24Å; T215-D218 PolarHBondContact OG1-N 3.25Å; T215-D218 PolarHBondContact OG1-OD2 3.03Å; D218-Q221 PolarHBondContact O-N 3.45Å; D218-K222 VanDerWaalsContact O-CB 3.26Å; D218-K222 WeakPolarHBondContact O-CB 3.16Å; D218-K222 WeakPolarHBondContact O-CD 3.49Å; D218-K222 WeakPolarHBondContact O-CG 3.49Å; D218-K222 PolarHBondContact O-N 3.23Å
219	K	76.4	Confident	79.7	Confident	153 Å²	153	103.4 Å²	103.4	67%	0.665	49%	0.492	S	S	*	.	H	α-helix	trans	-66.4	-40	180	-169.7	176.6	-179.8	-178.7	0	112.4	T215 Q216 K217 R223	T215-K219 PolarHBondContact O-N 3.19Å; T215-K219 VanDerWaalsContact O-N 3.1Å; Q216-K219 PolarHBondContact O-N 3.27Å; K217-K219 VanDerWaalsContact C-N 3.27Å; K217-K219 PolarHBondContact O-N 3.37Å; K219-R223 WeakPolarHBondContact O-CB 3.17Å; K219-R223 PolarHBondContact O-N 3.48Å; K219-R223 VanDerWaalsContact O-N 3.14Å
220	E	76	Confident	78.9	Confident	134 Å²	134	107 Å²	107	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-69.3	-42.3	174.9	-174.8	167	-138.5	0	0	111.8	Q216 K217 R223 M224	Q216-E220 WeakPolarHBondContact O-CB 3.41Å; Q216-E220 PolarHBondContact O-N 2.99Å; K217-E220 PolarHBondContact O-N 3.49Å; E220-R223 WeakPolarHBondContact O-CB 3.49Å; E220-R223 PolarHBondContact O-N 3.01Å; E220-M224 PolarHBondContact O-N 3.11Å
221	Q	76.8	Confident	77.7	Confident	138 Å²	138	112.6 Å²	112.6	65%	0.645	53%	0.532	S	S	*	.	H	α-helix	trans	-67.3	-40.5	178.8	-167.1	171	15.9	0	0	112.1	K217 D218 R223 M224 A225	K217-Q221 VanDerWaalsContact O-CB 3.24Å; K217-Q221 WeakPolarHBondContact O-CB 3.47Å; K217-Q221 PolarHBondContact O-N 3.34Å; D218-Q221 PolarHBondContact O-N 3.45Å; Q221-R223 VanDerWaalsContact C-N 3.33Å; Q221-R223 PolarHBondContact O-N 2.96Å; Q221-M224 PolarHBondContact O-N 3.01Å; Q221-A225 WeakPolarHBondContact O-CB 3.3Å; Q221-A225 PolarHBondContact O-N 3.29Å
222	K	79.1	Confident	76.3	Confident	109 Å²	109	112.9 Å²	112.9	47%	0.474	54%	0.537	S	S	.	.	H	α-helix	trans	-60	-41.6	170.1	-74.7	165.8	-177.9	174.1	0	111.5	D214 D218 Q226	D214-K222 IonicContact OD1-NZ 3.68Å; D214-K222 PolarHBondContact OD1-NZ 3.29Å; D214-K222 IonicContact OD2-NZ 2.61Å; D214-K222 PolarHBondContact OD2-NZ 3.39Å; D214-K222 VanDerWaalsContact OD2-NZ 3.12Å; D218-K222 VanDerWaalsContact O-CB 3.26Å; D218-K222 WeakPolarHBondContact O-CB 3.16Å; D218-K222 WeakPolarHBondContact O-CD 3.49Å; D218-K222 WeakPolarHBondContact O-CG 3.49Å; D218-K222 PolarHBondContact O-N 3.23Å; K222-Q226 WeakPolarHBondContact O-CB 3.44Å; K222-Q226 PolarHBondContact O-N 3.41Å
223	R	80.9	Confident	74.9	Confident	184 Å²	184	115.9 Å²	115.9	69%	0.694	55%	0.552	S	S	*	*	H	α-helix	trans	-65.8	-44.7	176.5	-171.7	-178.1	-174.8	-173.6	1.5	112	K219 E220 Q221 Q226 Q227	K219-R223 WeakPolarHBondContact O-CB 3.17Å; K219-R223 PolarHBondContact O-N 3.48Å; K219-R223 VanDerWaalsContact O-N 3.14Å; E220-R223 WeakPolarHBondContact O-CB 3.49Å; E220-R223 PolarHBondContact O-N 3.01Å; Q221-R223 VanDerWaalsContact C-N 3.33Å; Q221-R223 PolarHBondContact O-N 2.96Å; R223-Q226 PolarHBondContact O-N 3.24Å; R223-Q227 WeakPolarHBondContact O-CB 3.49Å; R223-Q227 PolarHBondContact O-N 2.85Å
224	M	79.1	Confident	73.5	Confident	135 Å²	135	121.9 Å²	121.9	67%	0.665	58%	0.577	S	S	*	*	H	α-helix	trans	-63.6	-43.3	176.7	-179.2	175.5	-76.8	0	0	111.7	E220 Q221 Q227 L228	E220-M224 PolarHBondContact O-N 3.11Å; Q221-M224 PolarHBondContact O-N 3.01Å; M224-Q227 PolarHBondContact O-N 3.48Å; M224-L228 WeakPolarHBondContact O-CB 3.28Å; M224-L228 PolarHBondContact O-N 3.39Å
225	A	78.6	Confident	72.2	Confident	50 Å²	50	122.8 Å²	122.8	41%	0.413	58%	0.581	S	S	.	*	H	α-helix	trans	-60.8	-45.8	174.5	0	0	0	0	0	111.7	Q221 Q227 L228 Q229	Q221-A225 WeakPolarHBondContact O-CB 3.3Å; Q221-A225 PolarHBondContact O-N 3.29Å; A225-Q227 VanDerWaalsContact C-N 3.31Å; A225-Q227 PolarHBondContact O-N 3.11Å; A225-L228 PolarHBondContact O-N 2.89Å; A225-Q229 VanDerWaalsContact O-CB 3.29Å; A225-Q229 WeakPolarHBondContact O-CB 3.5Å; A225-Q229 PolarHBondContact O-N 3.5Å
226	Q	80.7	Confident	71.2	Confident	125 Å²	125	124.9 Å²	124.9	58%	0.584	60%	0.596	S	S	*	*	H	α-helix	trans	-61.5	-38.8	176.5	-171.1	173.9	26.8	0	0	112.3	K222 R223 Q229 Q230	K222-Q226 WeakPolarHBondContact O-CB 3.44Å; K222-Q226 PolarHBondContact O-N 3.41Å; R223-Q226 PolarHBondContact O-N 3.24Å; Q226-Q229 PolarHBondContact O-N 3.14Å; Q226-Q230 WeakPolarHBondContact O-CG 3.43Å; Q226-Q230 PolarHBondContact O-N 2.66Å
227	Q	79.6	Confident	70.2	Confident	131 Å²	131	119.6 Å²	119.6	61%	0.612	58%	0.582	S	S	*	*	H	α-helix	trans	-70	-41.4	178	-171.3	170.9	-10.8	0	0	112.3	R223 M224 A225 Q229 Q230 Q231	R223-Q227 WeakPolarHBondContact O-CB 3.49Å; R223-Q227 PolarHBondContact O-N 2.85Å; M224-Q227 PolarHBondContact O-N 3.48Å; A225-Q227 VanDerWaalsContact C-N 3.31Å; A225-Q227 PolarHBondContact O-N 3.11Å; Q227-Q229 VanDerWaalsContact C-N 3.32Å; Q227-Q229 PolarHBondContact O-N 3.29Å; Q227-Q230 PolarHBondContact O-N 2.76Å; Q227-Q231 PolarHBondContact O-N 3.07Å; Q227-Q231 VanDerWaalsContact O-N 3.08Å
228	L	75.6	Confident	69.2	Low	106 Å²	106	116.7 Å²	116.7	56%	0.555	59%	0.586	S	S	*	*	H	α-helix	trans	-63.8	-38.4	173.2	-172.4	68.1	0	0	0	111.5	M224 A225 Q231 M232	M224-L228 WeakPolarHBondContact O-CB 3.28Å; M224-L228 PolarHBondContact O-N 3.39Å; A225-L228 PolarHBondContact O-N 2.89Å; L228-Q231 WeakPolarHBondContact O-CB 3.44Å; L228-Q231 PolarHBondContact O-N 3.17Å; L228-M232 PolarHBondContact O-N 2.78Å
229	Q	72.6	Confident	68.2	Low	139 Å²	139	118 Å²	118	65%	0.65	60%	0.6	S	S	*	*	H	α-helix	trans	-71.3	-33.4	178.5	-162.5	158	-6.4	0	0	112.2	A225 Q226 Q227 M232 Q233	A225-Q229 VanDerWaalsContact O-CB 3.29Å; A225-Q229 WeakPolarHBondContact O-CB 3.5Å; A225-Q229 PolarHBondContact O-N 3.5Å; Q226-Q229 PolarHBondContact O-N 3.14Å; Q227-Q229 VanDerWaalsContact C-N 3.32Å; Q227-Q229 PolarHBondContact O-N 3.29Å; Q229-M232 WeakPolarHBondContact O-CB 3.42Å; Q229-M232 PolarHBondContact O-N 3.01Å; Q229-Q233 WeakPolarHBondContact O-CB 3.28Å; Q229-Q233 PolarHBondContact O-N 3.3Å
230	Q	73	Confident	66.9	Low	116 Å²	116	116.4 Å²	116.4	54%	0.542	60%	0.603	S	S	.	*	H	α-helix	trans	-64.3	-39.1	168.1	-77.5	179.1	-15	0	0	112.5	Q226 Q227 Q233 Q234	Q226-Q230 WeakPolarHBondContact O-CG 3.43Å; Q226-Q230 PolarHBondContact O-N 2.66Å; Q227-Q230 PolarHBondContact O-N 2.76Å; Q230-Q233 PolarHBondContact O-N 3.38Å; Q230-Q234 PolarHBondContact O-N 3.33Å
231	Q	66.4	Low	65.1	Low	118 Å²	118	121.7 Å²	121.7	55%	0.551	62%	0.617	S	S	*	*	H	α-helix	trans	-63.6	-42.9	175.3	-168.1	174.8	32.7	0	0	111.7	Q227 L228 Q233 Q234 I235	Q227-Q231 PolarHBondContact O-N 3.07Å; Q227-Q231 VanDerWaalsContact O-N 3.08Å; L228-Q231 WeakPolarHBondContact O-CB 3.44Å; L228-Q231 PolarHBondContact O-N 3.17Å; Q231-Q233 VanDerWaalsContact C-N 3.29Å; Q231-Q233 PolarHBondContact O-N 3.42Å; Q231-Q234 PolarHBondContact O-N 3.16Å; Q231-I235 PolarHBondContact O-N 3.26Å
232	M	62.1	Low	63.3	Low	126 Å²	126	118.4 Å²	118.4	62%	0.621	62%	0.62	S	S	*	*	H	α-helix	trans	-58.3	-41.3	171.5	-164.3	87.2	76.2	0	0	111.7	L228 Q229 Q234 I235 S236	L228-M232 PolarHBondContact O-N 2.78Å; Q229-M232 WeakPolarHBondContact O-CB 3.42Å; Q229-M232 PolarHBondContact O-N 3.01Å; M232-Q234 PolarHBondContact O-N 3.03Å; M232-I235 PolarHBondContact O-N 3.09Å; M232-S236 PolarHBondContact O-N 3.06Å; M232-S236 VanDerWaalsContact O-N 3.08Å
233	Q	61.1	Low	61.1	Low	138 Å²	138	121 Å²	121	65%	0.645	64%	0.639	S	S	*	*	H	α-helix	trans	-72.7	-26.1	-177.6	-146.7	165.1	24.5	0	0	113	Q229 Q230 Q231 S236 A237	Q229-Q233 WeakPolarHBondContact O-CB 3.28Å; Q229-Q233 PolarHBondContact O-N 3.3Å; Q230-Q233 PolarHBondContact O-N 3.38Å; Q231-Q233 VanDerWaalsContact C-N 3.29Å; Q231-Q233 PolarHBondContact O-N 3.42Å; Q233-S236 PolarHBondContact O-N 3.1Å; Q233-A237 WeakPolarHBondContact O-CB 3.36Å; Q233-A237 PolarHBondContact O-N 2.95Å
234	Q	57.3	Low	59.3	Low	144 Å²	144	120.5 Å²	120.5	67%	0.673	65%	0.65	S	S	*	*	H	α-helix	trans	-69	-38.9	170	-74.1	-178.5	-10.6	0	0	112.4	Q230 Q231 M232 S236 A237 A238	Q230-Q234 PolarHBondContact O-N 3.33Å; Q231-Q234 PolarHBondContact O-N 3.16Å; M232-Q234 PolarHBondContact O-N 3.03Å; Q234-S236 VanDerWaalsContact C-N 3.3Å; Q234-S236 PolarHBondContact O-N 3.3Å; Q234-A237 PolarHBondContact O-N 3.39Å; Q234-A238 PolarHBondContact O-N 2.66Å; Q234-A238 VanDerWaalsContact O-N 3.15Å
235	I	55.2	Low	57.5	Low	123 Å²	123	118.8 Å²	118.8	63%	0.631	66%	0.657	S	S	*	*	H	α-helix	trans	-63.1	-40.1	172.7	-60.9	170.1	0	0	0	110.1	Q231 M232	Q231-I235 PolarHBondContact O-N 3.26Å; M232-I235 PolarHBondContact O-N 3.09Å
236	S	54.4	Low	55.8	Low	68 Å²	68	120.2 Å²	120.2	48%	0.476	68%	0.677	S	S	.	*	H	α-helix	trans	-69.5	-30.4	174.1	-174.6	0	0	0	0	113.9	M232 Q233 Q234 S239 V240	M232-S236 PolarHBondContact O-N 3.06Å; M232-S236 VanDerWaalsContact O-N 3.08Å; Q233-S236 PolarHBondContact O-N 3.1Å; Q234-S236 VanDerWaalsContact C-N 3.3Å; Q234-S236 PolarHBondContact O-N 3.3Å; S236-S239 PolarHBondContact O-N 2.91Å; S236-S239 PolarHBondContact O-OG 2.92Å; S236-V240 WeakPolarHBondContact O-CG2 3.5Å
237	A	45.8	Very low	53.7	Low	64 Å²	64	120.7 Å²	120.7	53%	0.529	68%	0.682	S	S	.	*	H	α-helix	trans	-70.9	-34.3	177.5	0	0	0	0	0	111.7	Q233 Q234 S239 V240	Q233-A237 WeakPolarHBondContact O-CB 3.36Å; Q233-A237 PolarHBondContact O-N 2.95Å; Q234-A237 PolarHBondContact O-N 3.39Å; A237-S239 PolarHBondContact O-N 3.37Å; A237-S239 VanDerWaalsContact O-N 3.15Å; A237-V240 PolarHBondContact O-N 3.09Å
238	A	48	Very low	51.8	Low	86 Å²	86	122.3 Å²	122.3	71%	0.711	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-13.4	176	0	0	0	0	0	114.1	Q234	Q234-A238 PolarHBondContact O-N 2.66Å; Q234-A238 VanDerWaalsContact O-N 3.15Å
239	S	52.7	Low	50.3	Low	92 Å²	92	122.6 Å²	122.6	64%	0.643	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	2.1	177.5	61.9	0	0	0	0	115	S236 A237	S236-S239 PolarHBondContact O-N 2.91Å; S236-S239 PolarHBondContact O-OG 2.92Å; A237-S239 PolarHBondContact O-N 3.37Å; A237-S239 VanDerWaalsContact O-N 3.15Å
240	V	49.2	Very low	48.9	Very low	118 Å²	118	122.8 Å²	122.8	72%	0.715	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	-20.8	-171.8	176.1	0	0	0	0	114	S236 A237	S236-V240 WeakPolarHBondContact O-CG2 3.5Å; A237-V240 PolarHBondContact O-N 3.09Å
241	W	38.4	Very low	48	Very low	245 Å²	245	120.5 Å²	120.5	93%	0.928	71%	0.714	S	S	*	*	S	Bend	trans	-103.4	99	168.2	-154.1	-57.6	0	0	0	110.1
242	G	40.1	Very low	47.1	Very low	69 Å²	69	119.7 Å²	119.7	71%	0.711	72%	0.719	S	S	*	*			trans	-69.9	147.4	-173.9	0	0	0	0	0	114.2
243	N	32.7	Very low	46.2	Very low	164 Å²	164	120.9 Å²	120.9	88%	0.877	72%	0.723	S	S	*	*			trans	-136.4	147.2	155.6	-158.2	-12.3	0	0	0	109.2	A245	N243-A245 PolarHBondContact O-N 2.86Å
244	L	41.8	Very low	45.6	Very low	174 Å²	174	123.5 Å²	123.5	91%	0.911	73%	0.728	S	S	*	*			trans	-99.9	24.5	-143.5	-170	49.3	0	0	0	115
245	A	43.3	Very low	45.4	Very low	99 Å²	99	122.5 Å²	122.5	82%	0.818	73%	0.727	S	S	*	*	S	Bend	trans	-143.9	120.6	-175.7	0	0	0	0	0	114.5	N243	N243-A245 PolarHBondContact O-N 2.86Å
246	G	42.7	Very low	45.4	Very low	80 Å²	80	119.5 Å²	119.5	83%	0.825	72%	0.721	S	S	*	*			trans	92.6	52.8	147.1	0	0	0	0	0	119.8
247	L	36.3	Very low	45.2	Very low	135 Å²	135	122.2 Å²	122.2	71%	0.707	73%	0.729	S	S	*	*			trans	-148.1	50.5	162	-133.8	168.4	0	0	0	115	T249 L250	L247-T249 PolarHBondContact O-N 2.92Å; L247-T249 VanDerWaalsContact O-N 3.16Å; L247-L250 HydrophobicContact CD2-CD1 4.32Å; L247-L250 HydrophobicContact CD2-CG 4.42Å
248	N	39.8	Very low	45.6	Very low	164 Å²	164	126.1 Å²	126.1	88%	0.877	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	67.5	176.1	-168.5	6.1	0	0	0	112.2
249	T	43.2	Very low	46	Very low	112 Å²	112	127.8 Å²	127.8	69%	0.687	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.8	-19.8	-179.3	34.5	0	0	0	0	117.7	L247	L247-T249 PolarHBondContact O-N 2.92Å; L247-T249 VanDerWaalsContact O-N 3.16Å
250	L	43.6	Very low	45.9	Very low	143 Å²	143	129.2 Å²	129.2	75%	0.749	72%	0.724	S	S	*	*			trans	-115.1	27.8	-168.7	-64.7	177.7	0	0	0	115.5	L247	L247-L250 HydrophobicContact CD2-CD1 4.32Å; L247-L250 HydrophobicContact CD2-CG 4.42Å
251	G	53.5	Low	46.1	Very low	69 Å²	69	129.3 Å²	129.3	71%	0.711	72%	0.72	S	S	*	*			trans	-66.4	-34.6	-176	0	0	0	0	0	119.5
252	P	48.8	Very low	46.9	Very low	101 Å²	101	122.1 Å²	122.1	66%	0.656	70%	0.699	S	S	*	*	S	Bend	trans	-91.7	-22.7	-161.2	32.6	-35.5	0	0	0	116.4
253	Q	42.2	Very low	47.5	Very low	150 Å²	150	125.7 Å²	125.7	70%	0.701	70%	0.697	S	S	*	*	H	α-helix	trans	-73.3	-36.4	-169.4	-76.8	-77.5	-17.5	0	0	113.9
254	Y	48.9	Very low	48.2	Very low	193 Å²	193	123.9 Å²	123.9	76%	0.757	68%	0.684	S	S	*	*	H	α-helix	trans	-72.9	-38.5	-172	-164.4	-99.1	0	0	0	113	A256 L257 Y258	Y254-A256 VanDerWaalsContact C-N 3.34Å; Y254-A256 PolarHBondContact O-N 3.39Å; Y254-L257 PolarHBondContact O-N 2.89Å; Y254-Y258 PolarHBondContact O-N 3.03Å
255	L	53.6	Low	48.2	Very low	124 Å²	124	120.9 Å²	120.9	65%	0.649	67%	0.672	S	S	*	*	H	α-helix	trans	-67.6	-34.7	179.9	-174.7	60.7	0	0	0	112.1	Y258 L259	L255-Y258 PolarHBondContact O-N 2.97Å; L255-L259 PolarHBondContact O-N 2.84Å
256	A	53.8	Low	48.1	Very low	60 Å²	60	120.1 Å²	120.1	50%	0.496	67%	0.666	S	S	.	*	H	α-helix	trans	-62.1	-44.4	175.8	0	0	0	0	0	112	Y254 Y258 L259 Q260	Y254-A256 VanDerWaalsContact C-N 3.34Å; Y254-A256 PolarHBondContact O-N 3.39Å; A256-Y258 VanDerWaalsContact C-N 3.35Å; A256-Y258 PolarHBondContact O-N 3.28Å; A256-L259 PolarHBondContact O-N 3.01Å; A256-Q260 VanDerWaalsContact O-CB 3.29Å; A256-Q260 WeakPolarHBondContact O-CB 3.46Å; A256-Q260 PolarHBondContact O-N 3.47Å
257	L	51.9	Low	48.1	Very low	125 Å²	125	121.1 Å²	121.1	65%	0.654	66%	0.661	S	S	*	*	H	α-helix	trans	-63.2	-38.2	176.7	-99.4	166.7	0	0	0	112.9	Y254 L261	Y254-L257 PolarHBondContact O-N 2.89Å; L257-L261 PolarHBondContact O-N 2.93Å
258	Y	53.4	Low	48.3	Very low	146 Å²	146	119.3 Å²	119.3	57%	0.573	66%	0.659	S	S	*	*	H	α-helix	trans	-65.9	-42.8	176	-171.5	-102.8	0	0	0	112	Y254 L255 A256 L261 L262	Y254-Y258 PolarHBondContact O-N 3.03Å; L255-Y258 PolarHBondContact O-N 2.97Å; A256-Y258 VanDerWaalsContact C-N 3.35Å; A256-Y258 PolarHBondContact O-N 3.28Å; Y258-L261 PolarHBondContact O-N 3.11Å; Y258-L262 HydrophobicContact CD1-CD1 4.3Å; Y258-L262 HydrophobicContact CE1-CD1 3.96Å; Y258-L262 HydrophobicContact CE2-CD1 4.47Å; Y258-L262 WeakPolarHBondContact O-CD1 3.42Å; Y258-L262 PolarHBondContact O-N 3.2Å
259	L	55.9	Low	48.5	Very low	121 Å²	121	115.8 Å²	115.8	63%	0.634	66%	0.662	S	S	*	*	H	α-helix	trans	-70	-38.9	179.4	-157.3	69.2	0	0	0	112.3	L255 A256 L261 L262 Q263	L255-L259 PolarHBondContact O-N 2.84Å; A256-L259 PolarHBondContact O-N 3.01Å; L259-L261 PolarHBondContact O-N 3.19Å; L259-L262 PolarHBondContact O-N 3.46Å; L259-Q263 PolarHBondContact O-N 2.94Å
260	Q	51.9	Low	48.1	Very low	122 Å²	122	117 Å²	117	57%	0.57	66%	0.664	S	S	*	*	H	α-helix	trans	-57.1	-36.9	173.5	-171	75.8	6.4	0	0	112.1	A256	A256-Q260 VanDerWaalsContact O-CB 3.29Å; A256-Q260 WeakPolarHBondContact O-CB 3.46Å; A256-Q260 PolarHBondContact O-N 3.47Å
261	L	52.8	Low	47.9	Very low	119 Å²	119	118.1 Å²	118.1	62%	0.623	67%	0.67	S	S	*	*	H	α-helix	trans	-71.4	-42.6	-178.5	-171.7	63.9	0	0	0	112.2	L257 Y258 L259 Q263 Q264	L257-L261 PolarHBondContact O-N 2.93Å; Y258-L261 PolarHBondContact O-N 3.11Å; L259-L261 PolarHBondContact O-N 3.19Å; L261-Q263 VanDerWaalsContact C-N 3.3Å; L261-Q263 PolarHBondContact O-N 3.21Å; L261-Q264 PolarHBondContact O-N 3.45Å
262	L	54.7	Low	47.2	Very low	95 Å²	95	121.7 Å²	121.7	50%	0.497	67%	0.673	S	S	.	*	H	α-helix	trans	-63.4	-35.9	176.3	-89.4	78.1	0	0	0	112.2	Y258 L259 Q264 T265	Y258-L262 HydrophobicContact CD1-CD1 4.3Å; Y258-L262 HydrophobicContact CE1-CD1 3.96Å; Y258-L262 HydrophobicContact CE2-CD1 4.47Å; Y258-L262 WeakPolarHBondContact O-CD1 3.42Å; Y258-L262 PolarHBondContact O-N 3.2Å; L259-L262 PolarHBondContact O-N 3.46Å; L262-Q264 VanDerWaalsContact C-N 3.29Å; L262-Q264 PolarHBondContact O-N 3.46Å; L262-T265 PolarHBondContact O-N 2.94Å; L262-T265 PolarHBondContact O-OG1 3.36Å
263	Q	52.8	Low	46.9	Very low	143 Å²	143	123.1 Å²	123.1	67%	0.668	68%	0.68	S	S	*	*	H	α-helix	trans	-62.6	-31.8	-177.4	-167.1	68.3	80.8	0	0	113.2	L259 L261 T265 A266	L259-Q263 PolarHBondContact O-N 2.94Å; L261-Q263 VanDerWaalsContact C-N 3.3Å; L261-Q263 PolarHBondContact O-N 3.21Å; Q263-T265 VanDerWaalsContact C-N 3.32Å; Q263-T265 PolarHBondContact O-N 3.39Å; Q263-A266 PolarHBondContact O-N 2.93Å
264	Q	46.4	Very low	46.6	Very low	127 Å²	127	124.1 Å²	124.1	59%	0.593	69%	0.689	S	S	*	*	H	α-helix	trans	-74.3	-20.6	-179.9	-66.7	-172.2	12.8	0	0	113.5	L261 L262 A266 S267	L261-Q264 PolarHBondContact O-N 3.45Å; L262-Q264 VanDerWaalsContact C-N 3.29Å; L262-Q264 PolarHBondContact O-N 3.46Å; Q264-A266 PolarHBondContact O-N 3.42Å; Q264-S267 PolarHBondContact O-OG 2.93Å
265	T	42.3	Very low	46	Very low	110 Å²	110	120.6 Å²	120.6	68%	0.675	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-12.7	176.3	-5.8	0	0	0	0	113.6	L262 Q263	L262-T265 PolarHBondContact O-N 2.94Å; L262-T265 PolarHBondContact O-OG1 3.36Å; Q263-T265 VanDerWaalsContact C-N 3.32Å; Q263-T265 PolarHBondContact O-N 3.39Å
266	A	40.9	Very low	44.9	Very low	83 Å²	83	119.9 Å²	119.9	69%	0.686	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-13.2	-175.7	0	0	0	0	0	115	Q263 Q264	Q263-A266 PolarHBondContact O-N 2.93Å; Q264-A266 PolarHBondContact O-N 3.42Å
267	S	43.6	Very low	44.1	Very low	102 Å²	102	124.3 Å²	124.3	71%	0.713	71%	0.712	S	S	*	*	S	Bend	trans	-109.4	2.2	-172	57.6	0	0	0	0	115.1	Q264	Q264-S267 PolarHBondContact O-OG 2.93Å
268	S	40.9	Very low	43.4	Very low	97 Å²	97	127.2 Å²	127.2	68%	0.678	72%	0.722	S	S	*	*	S	Bend	trans	-124.8	86	179.7	-67.6	0	0	0	0	110.9	N270	S268-N270 PolarHBondContact O-N 3.01Å
269	G	42.4	Very low	43.3	Very low	90 Å²	90	125.7 Å²	125.7	93%	0.928	73%	0.73	S	S	*	*			trans	-70.5	99.2	-175.8	0	0	0	0	0	113.8
270	N	36.3	Very low	42.1	Very low	138 Å²	138	129.3 Å²	129.3	74%	0.738	75%	0.746	S	S	*	*			trans	-148.9	113.3	161.1	-156.9	-24	0	0	0	110.9	S268	S268-N270 PolarHBondContact O-N 3.01Å
271	L	37.8	Very low	41.3	Very low	166 Å²	166	126.4 Å²	126.4	87%	0.869	75%	0.749	S	S	*	*			trans	-109.8	64.4	-158.7	-171.9	95.7	0	0	0	112.5
272	N	39.8	Very low	40.7	Very low	144 Å²	144	124.6 Å²	124.6	77%	0.77	76%	0.76	S	S	*	*			trans	-144.6	15.4	-173.8	-89.3	-58.3	0	0	0	117.1
273	T	41.7	Very low	40	Very low	131 Å²	131	128.5 Å²	128.5	80%	0.804	78%	0.78	S	S	*	*			trans	-119.9	7.9	-178.5	52.2	0	0	0	0	115.1	S275	T273-S275 PolarHBondContact O-N 3.5Å
274	L	36.2	Very low	39.3	Very low	171 Å²	171	128.5 Å²	128.5	90%	0.895	78%	0.784	S	S	*	*			trans	-100.1	60	-178.2	-167.7	67.9	0	0	0	112.1
275	S	35.8	Very low	39.3	Very low	119 Å²	119	126.8 Å²	126.8	83%	0.832	79%	0.792	S	S	*	*	S	Bend	trans	-149.7	8.1	-179	-54.8	0	0	0	0	116	T273	T273-S275 PolarHBondContact O-N 3.5Å
276	S	31.4	Very low	39.5	Very low	108 Å²	108	129.5 Å²	129.5	76%	0.755	80%	0.799	S	S	*	*	S	Bend	trans	-130.2	30.3	-172.7	64.8	0	0	0	0	114.6
277	L	36.3	Very low	39.8	Very low	153 Å²	153	133 Å²	133	80%	0.801	80%	0.802	S	S	*	*			trans	-134.2	151.4	167.1	-77.5	172.1	0	0	0	109.4
278	H	38.8	Very low	40.2	Very low	186 Å²	186	134.7 Å²	134.7	86%	0.861	80%	0.802	S	S	*	*			trans	84.5	154.4	-173.1	-58.1	-75.2	0	0	0	116.8
279	P	49.9	Very low	40.5	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	80%	0.801	S	S	*	*			cis	-123.6	141	-1.2	36.2	-21.4	0	0	0	115.7
280	M	30.9	Very low	40.5	Very low	197 Å²	197	138.6 Å²	138.6	97%	0.97	79%	0.789	S	S	*	*	S	Bend	trans	-164.4	101.1	147.2	-120.8	-65	162.9	0	0	109
281	G	35	Very low	41.1	Very low	62 Å²	62	138 Å²	138	64%	0.639	79%	0.785	S	S	*	*			cis	-173.9	174.5	-8.5	0	0	0	0	0	111.5
282	G	41	Very low	41.5	Very low	81 Å²	81	133 Å²	133	84%	0.835	77%	0.768	S	S	*	*			trans	84.9	31.8	152.6	0	0	0	0	0	120.6
283	L	38.6	Very low	41.7	Very low	176 Å²	176	129 Å²	129	92%	0.921	76%	0.755	S	S	*	*			trans	-132.5	136.4	162.3	-73.4	177.5	0	0	0	111.7
284	N	39.5	Very low	41.8	Very low	143 Å²	143	129 Å²	129	77%	0.765	75%	0.749	S	S	*	*			trans	-83.3	129.1	-175.3	-81.1	-50.6	0	0	0	112.5	M286 Q287	N284-M286 PolarHBondContact O-N 2.87Å; N284-M286 VanDerWaalsContact O-N 3.08Å; N284-Q287 PolarHBondContact O-N 3.3Å
285	A	47	Very low	42.3	Very low	92 Å²	92	124.2 Å²	124.2	76%	0.76	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-21.8	-175	0	0	0	0	0	115.1	Q287	A285-Q287 VanDerWaalsContact C-N 3.34Å; A285-Q287 PolarHBondContact O-N 3.25Å
286	M	46.2	Very low	42.6	Very low	166 Å²	166	122 Å²	122	82%	0.818	72%	0.723	S	S	*	*	H	α-helix	trans	-69.6	-27.9	-179.5	-159.6	-173.9	-65	0	0	113.4	N284 L288	N284-M286 PolarHBondContact O-N 2.87Å; N284-M286 VanDerWaalsContact O-N 3.08Å; M286-L288 VanDerWaalsContact C-N 3.31Å; M286-L288 PolarHBondContact O-N 2.79Å
287	Q	46.3	Very low	43	Very low	158 Å²	158	120.3 Å²	120.3	74%	0.738	72%	0.716	S	S	*	*	H	α-helix	trans	-67.5	-32.7	-177.5	-162.1	75.2	-5.2	0	0	112.3	N284 A285	N284-Q287 PolarHBondContact O-N 3.3Å; A285-Q287 VanDerWaalsContact C-N 3.34Å; A285-Q287 PolarHBondContact O-N 3.25Å
288	L	51.4	Low	43.2	Very low	137 Å²	137	117.3 Å²	117.3	72%	0.717	71%	0.713	S	S	*	*	H	α-helix	trans	-73.5	-32.8	-173.5	-161.8	68	0	0	0	112.4	M286	M286-L288 VanDerWaalsContact C-N 3.31Å; M286-L288 PolarHBondContact O-N 2.79Å
289	Q	48.3	Very low	43.2	Very low	143 Å²	143	113.5 Å²	113.5	67%	0.668	71%	0.707	S	S	*	*	H	α-helix	trans	-68.7	-35.5	179.2	-176.2	57.6	72.2	0	0	112.7
290	N	42.3	Very low	42.8	Very low	125 Å²	125	112.4 Å²	112.4	67%	0.668	71%	0.708	S	S	*	*	H	α-helix	trans	-76.2	-32.3	-177.4	-157.5	24.3	0	0	0	112.1	A292 A293	N290-A292 VanDerWaalsContact C-N 3.34Å; N290-A292 PolarHBondContact O-N 2.88Å; N290-A293 PolarHBondContact O-N 3.37Å
291	L	48	Very low	43.1	Very low	125 Å²	125	107.3 Å²	107.3	65%	0.654	70%	0.697	S	S	*	*	H	α-helix	trans	-68.5	-33	177.7	-160.8	70.1	0	0	0	112.3
292	A	48.1	Very low	43	Very low	61 Å²	61	113.7 Å²	113.7	50%	0.504	71%	0.71	S	S	.	*	H	α-helix	trans	-66	-35.6	175.6	0	0	0	0	0	113	N290 A295	N290-A292 VanDerWaalsContact C-N 3.34Å; N290-A292 PolarHBondContact O-N 2.88Å; A292-A295 PolarHBondContact O-N 2.67Å
293	A	42.8	Very low	42.5	Very low	61 Å²	61	117.2 Å²	117.2	50%	0.504	71%	0.71	S	S	.	*	H	α-helix	trans	-67	-36.6	179.5	0	0	0	0	0	112.6	N290 A296	N290-A293 PolarHBondContact O-N 3.37Å; A293-A296 PolarHBondContact O-N 3.04Å
294	L	44.5	Very low	42.1	Very low	131 Å²	131	115.3 Å²	115.3	69%	0.686	71%	0.706	S	S	*	*	H	α-helix	trans	-69.9	-33.8	-179.8	-171.9	61.5	0	0	0	112.6	A296 A297	L294-A296 VanDerWaalsContact C-N 3.32Å; L294-A296 PolarHBondContact O-N 3.07Å; L294-A297 PolarHBondContact O-N 2.82Å
295	A	45.9	Very low	42	Very low	70 Å²	70	114 Å²	114	58%	0.579	71%	0.706	S	S	*	*	H	α-helix	trans	-65.5	-32.5	178.5	0	0	0	0	0	113.1	A292 A297 A298	A292-A295 PolarHBondContact O-N 2.67Å; A295-A297 VanDerWaalsContact C-N 3.3Å; A295-A297 PolarHBondContact O-N 2.88Å; A295-A298 PolarHBondContact O-N 3.34Å
296	A	43.2	Very low	41	Very low	72 Å²	72	115.4 Å²	115.4	60%	0.595	71%	0.71	S	S	*	*	H	α-helix	trans	-70.6	-21.9	-178.2	0	0	0	0	0	114.1	A293 L294	A293-A296 PolarHBondContact O-N 3.04Å; L294-A296 VanDerWaalsContact C-N 3.32Å; L294-A296 PolarHBondContact O-N 3.07Å
297	A	38.8	Very low	40	Very low	74 Å²	74	110.8 Å²	110.8	61%	0.612	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-20.9	179.3	0	0	0	0	0	113.5	L294 A295	L294-A297 PolarHBondContact O-N 2.82Å; A295-A297 VanDerWaalsContact C-N 3.3Å; A295-A297 PolarHBondContact O-N 2.88Å
298	A	40.3	Very low	39.2	Very low	89 Å²	89	109.4 Å²	109.4	74%	0.736	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-16.7	-172.3	0	0	0	0	0	114.4	A295	A295-A298 PolarHBondContact O-N 3.34Å
299	S	39.7	Very low	38.1	Very low	106 Å²	106	110.5 Å²	110.5	74%	0.741	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	13.6	-173.7	57.4	0	0	0	0	114.9
300	A	40.7	Very low	37	Very low	92 Å²	92	108 Å²	108	76%	0.76	72%	0.718	S	S	*	*	S	Bend	trans	-104.1	11.4	-170.9	0	0	0	0	0	115.2
301	A	38.6	Very low	36.3	Very low	89 Å²	89	110 Å²	110	74%	0.736	73%	0.727	S	S	*	*	S	Bend	trans	-147.3	56.9	-170.8	0	0	0	0	0	115.7
302	Q	32.2	Very low	35.3	Very low	196 Å²	196	109.3 Å²	109.3	92%	0.916	73%	0.728	S	S	*	*			trans	-162.1	108.7	151.9	-116.6	169.2	34.4	0	0	112.7
303	N	30.4	Very low	34.3	Very low	155 Å²	155	111.8 Å²	111.8	83%	0.829	74%	0.737	S	S	*	*			trans	-161.5	149.8	163.6	-129.1	-28.3	0	0	0	109.9
304	T	29.6	Very low	33.9	Very low	136 Å²	136	113.8 Å²	113.8	83%	0.834	75%	0.747	S	S	*	*			trans	79	148.5	-174.3	70.2	0	0	0	0	117.3
305	P	37	Very low	33.3	Very low	117 Å²	117	113.2 Å²	113.2	76%	0.76	76%	0.755	S	S	*	*			trans	-137.1	-176.3	-139	43.1	-25.8	0	0	0	117.6
306	S	27	Very low	32.8	Very low	121 Å²	121	115.3 Å²	115.3	85%	0.846	77%	0.765	S	S	*	*			trans	103.6	147.9	157.4	-42.1	0	0	0	0	117.6
307	G	25.8	Very low	32.8	Very low	68 Å²	68	118 Å²	118	70%	0.701	78%	0.776	S	S	*	*			trans	118.7	86.4	153.4	0	0	0	0	0	119.1
308	T	27.7	Very low	32.2	Very low	129 Å²	129	122.1 Å²	122.1	79%	0.791	79%	0.787	S	S	*	*			trans	27.7	131.5	138.3	55.8	0	0	0	0	123.4
309	N	28.4	Very low	31.7	Very low	160 Å²	160	123.3 Å²	123.3	86%	0.856	79%	0.79	S	S	*	*			trans	76.3	153.5	138.4	-76.9	-3.4	0	0	0	123.2
310	A	26.6	Very low	31.3	Very low	92 Å²	92	124.4 Å²	124.4	76%	0.76	79%	0.792	S	S	*	*			trans	81.4	100.6	152.8	0	0	0	0	0	121
311	L	27.5	Very low	30.6	Very low	166 Å²	166	127.2 Å²	127.2	87%	0.869	79%	0.793	S	S	*	*				48.8	139.8	121	-117.1	74	0	0	0	123.5
312	T	26.4	Very low	30.1	Very low	111 Å²	111	129 Å²	129	68%	0.681	80%	0.796	S	S	*	*			trans	88.2	134.4	134.6	-153.5	0	0	0	0	123
313	T	26.7	Very low	30	Very low	112 Å²	112	124.8 Å²	124.8	69%	0.687	79%	0.787	S	S	*	*			trans	53.7	106.9	149.6	40.4	0	0	0	0	121.5
314	S	35.3	Very low	29.9	Very low	103 Å²	103	123.4 Å²	123.4	72%	0.72	79%	0.79	S	S	*	*				18.1	122.8	126.2	57.9	0	0	0	0	120.2
315	S	31.3	Very low	29.8	Very low	120 Å²	120	122.2 Å²	122.2	84%	0.839	79%	0.794	S	S	*	*				-173.1	148.8	125.8	-81.8	0	0	0	0	112.2
316	S	35.6	Very low	29.3	Very low	113 Å²	113	120.5 Å²	120.5	79%	0.79	80%	0.798	S	S	*	*			trans	-81.5	160.4	155.9	-54.4	0	0	0	0	109.2
317	P	42.3	Very low	29.6	Very low	128 Å²	128	120.5 Å²	120.5	83%	0.831	80%	0.797	S	S	*	*				-148.5	171	101.7	37.6	-21.3	0	0	0	116
318	L	27.7	Very low	29.7	Very low	162 Å²	162	123 Å²	123	85%	0.848	81%	0.805	S	S	*	*			trans	-78.9	160.1	168.9	-61.2	147.7	0	0	0	111.4
319	S	29.2	Very low	30.7	Very low	114 Å²	114	123 Å²	123	80%	0.797	81%	0.807	S	S	*	*			trans	175.5	169.8	130.5	-83.5	0	0	0	0	114.5
320	V	30.4	Very low	30.8	Very low	128 Å²	128	121.1 Å²	121.1	78%	0.776	81%	0.806	S	S	*	*			trans	65.3	107.9	176.2	-46.6	0	0	0	0	116
321	L	27.2	Very low	31.2	Very low	151 Å²	151	122.5 Å²	122.5	79%	0.791	81%	0.81	S	S	*	*				68.4	111.3	54.4	-57	170.9	0	0	0	111.6
322	T	27.7	Very low	31.3	Very low	128 Å²	128	119.6 Å²	119.6	79%	0.785	80%	0.804	S	S	*	*				60.8	131.2	75.4	-122.8	0	0	0	0	112.3
323	S	30.8	Very low	31.4	Very low	106 Å²	106	119.5 Å²	119.5	74%	0.741	81%	0.808	S	S	*	*			cis	-160.3	164.2	3.2	57.3	0	0	0	0	110.4
324	S	27	Very low	31.6	Very low	127 Å²	127	119.4 Å²	119.4	89%	0.888	81%	0.811	S	S	*	*			trans	-161.7	142.7	149.9	47.9	0	0	0	0	112.7
325	A	27.5	Very low	31.3	Very low	111 Å²	111	121.9 Å²	121.9	92%	0.917	82%	0.817	S	S	*	*			trans	-153.4	150.3	168.4	0	0	0	0	0	107.7
326	G	26.9	Very low	31.3	Very low	81 Å²	81	120.8 Å²	120.8	84%	0.835	81%	0.809	S	S	*	*			trans	151.9	113.3	175.4	0	0	0	0	0	114.2
327	S	32.8	Very low	31.1	Very low	120 Å²	120	122.6 Å²	122.6	84%	0.839	82%	0.815	S	S	*	*			trans	-91.8	165	173.4	-43.7	0	0	0	0	111.5
328	S	29	Very low	30.6	Very low	122 Å²	122	124 Å²	124	85%	0.853	82%	0.815	S	S	*	*			trans	-158.2	145.3	150.9	-82.4	0	0	0	0	112.2
329	P	47.7	Very low	31.9	Very low	129 Å²	129	122.1 Å²	122.1	84%	0.838	81%	0.813	S	S	*	*			trans	-121.1	-170.2	-175	44.2	-33.2	0	0	0	114
330	S	30.6	Very low	31.9	Very low	120 Å²	120	124.2 Å²	124.2	84%	0.839	81%	0.813	S	S	*	*			trans	-138.4	161.7	165.5	56	0	0	0	0	112.5
331	S	35	Very low	32	Very low	120 Å²	120	122.1 Å²	122.1	84%	0.839	81%	0.81	S	S	*	*			trans	-90.4	164.8	-172.1	47.6	0	0	0	0	113
332	S	30.3	Very low	32.2	Very low	106 Å²	106	119.9 Å²	119.9	74%	0.741	81%	0.806	S	S	*	*			cis	-149.7	170.9	42.3	47.4	0	0	0	0	111
333	S	27.8	Very low	32.3	Very low	109 Å²	109	122 Å²	122	76%	0.762	81%	0.812	S	S	*	*			cis	-147.9	-175.4	34.7	-64.5	0	0	0	0	114
334	S	32.4	Very low	32.2	Very low	109 Å²	109	120.7 Å²	120.7	76%	0.762	82%	0.815	S	S	*	*			trans	-58.5	163.6	177.1	45.1	0	0	0	0	114.4
335	N	29	Very low	32.5	Very low	156 Å²	156	119.5 Å²	119.5	83%	0.834	81%	0.813	S	S	*	*			cis	-150.9	169.8	30.6	-143.5	0.3	0	0	0	114.8
336	S	29.4	Very low	32.5	Very low	97 Å²	97	121.7 Å²	121.7	68%	0.678	81%	0.808	S	S	*	*			trans	-90.1	156.1	-161.1	-44	0	0	0	0	118.2
337	V	32	Very low	32.6	Very low	151 Å²	151	125.8 Å²	125.8	92%	0.915	81%	0.806	S	S	*	*				-156.3	164.8	126.5	-97.9	0	0	0	0	110.5
338	N	32.4	Very low	32.4	Very low	158 Å²	158	126 Å²	126	85%	0.845	80%	0.802	S	S	*	*			trans	-104	164.3	-152	-75.7	-29.4	0	0	0	117.6
339	P	54.7	Low	32.5	Very low	121 Å²	121	128.7 Å²	128.7	79%	0.786	81%	0.806	S	S	*	*			trans	-113.2	179.4	-174.1	43.5	-35.4	0	0	0	115.7
340	I	29.2	Very low	31.5	Very low	158 Å²	158	127 Å²	127	81%	0.81	80%	0.803	S	S	*	*			trans	-149.2	116.7	162.9	-154.5	160	0	0	0	106.9
341	A	32.9	Very low	31.3	Very low	85 Å²	85	124.9 Å²	124.9	70%	0.702	80%	0.8	S	S	*	*				64.8	139.9	80.9	0	0	0	0	0	114
342	S	31.4	Very low	31.1	Very low	103 Å²	103	123.8 Å²	123.8	72%	0.72	80%	0.799	S	S	*	*			cis	-171.7	156.6	-1.1	40.1	0	0	0	0	114
343	L	30.1	Very low	30.8	Very low	174 Å²	174	125.2 Å²	125.2	91%	0.911	80%	0.803	S	S	*	*			trans	39.2	137.3	145.9	-81.7	81.5	0	0	0	123.5
344	G	29	Very low	31	Very low	77 Å²	77	124.6 Å²	124.6	79%	0.794	81%	0.805	S	S	*	*			trans	93	164.3	136.9	0	0	0	0	0	117.7
345	A	32.7	Very low	30.8	Very low	103 Å²	103	122.9 Å²	122.9	85%	0.851	80%	0.804	S	S	*	*			cis	-161.3	-176.4	-14.4	0	0	0	0	0	110.6
346	L	27.3	Very low	31	Very low	157 Å²	157	123.5 Å²	123.5	82%	0.822	81%	0.807	S	S	*	*			trans	-49.3	153.3	170.8	-77.4	145.3	0	0	0	114.5
347	Q	29.1	Very low	31.2	Very low	167 Å²	167	126 Å²	126	78%	0.78	81%	0.812	S	S	*	*				165.4	145.9	101.7	-166.1	66.3	2.6	0	0	113
348	T	29	Very low	31.3	Very low	125 Å²	125	124.5 Å²	124.5	77%	0.767	80%	0.803	S	S	*	*			trans	-87	134.7	170.3	-49.7	0	0	0	0	111.9
349	L	30.8	Very low	31.3	Very low	177 Å²	177	119.9 Å²	119.9	93%	0.927	79%	0.793	S	S	*	*			trans	-158.9	168.4	153.4	-152.2	55.8	0	0	0	112.8
350	A	25.7	Very low	30.3	Very low	94 Å²	94	119.7 Å²	119.7	78%	0.777	79%	0.794	S	S	*	*			trans	-140.6	154.6	-177.7	0	0	0	0	0	113.1
351	G	26.2	Very low	30.5	Very low	76 Å²	76	120 Å²	120	78%	0.784	80%	0.797	S	S	*	*			trans	97.9	145	149.2	0	0	0	0	0	118.9
352	A	30.8	Very low	30.6	Very low	97 Å²	97	121 Å²	121	80%	0.802	81%	0.805	S	S	*	*			trans	66.4	149.6	161.7	0	0	0	0	0	118.2
353	T	25.3	Very low	30.6	Very low	135 Å²	135	119.7 Å²	119.7	83%	0.828	81%	0.808	S	S	*	*			cis	-170.2	156.9	-17.5	27.9	0	0	0	0	107
354	A	31.5	Very low	31	Very low	97 Å²	97	120.2 Å²	120.2	80%	0.802	81%	0.808	S	S	*	*			cis	-172.3	163.1	-18	0	0	0	0	0	109.6
355	G	28.5	Very low	31	Very low	73 Å²	73	120.9 Å²	120.9	75%	0.753	81%	0.806	S	S	*	*			trans	102.9	147.6	167.8	0	0	0	0	0	115.7
356	L	32.1	Very low	31	Very low	169 Å²	169	119.8 Å²	119.8	89%	0.885	80%	0.797	S	S	*	*			cis	-149.4	142.2	-2.6	-93.5	174.4	0	0	0	111.9
357	N	34.7	Very low	31.2	Very low	148 Å²	148	120 Å²	120	79%	0.791	80%	0.798	S	S	*	*			trans	51	122.7	144.2	-130.9	4.8	0	0	0	118.7
358	V	34.8	Very low	31.3	Very low	121 Å²	121	119.9 Å²	119.9	73%	0.733	80%	0.803	S	S	*	*			cis	-154.4	166.1	19.4	71.8	0	0	0	0	107.1
359	G	32	Very low	31.2	Very low	61 Å²	61	117.3 Å²	117.3	63%	0.629	80%	0.801	S	S	*	*			cis	98.2	145.5	22.4	0	0	0	0	0	110.9
360	S	32.7	Very low	31.2	Very low	116 Å²	116	112.2 Å²	112.2	81%	0.811	79%	0.791	S	S	*	*			cis	-166.2	171.8	0.7	-71.8	0	0	0	0	109.4
361	L	34.3	Very low	31.5	Very low	166 Å²	166	116.5 Å²	116.5	87%	0.869	80%	0.8	S	S	*	*			cis	179.6	122.1	-37	177.9	80.2	0	0	0	107.5
362	A	33.8	Very low	31.6	Very low	105 Å²	105	116.1 Å²	116.1	87%	0.868	80%	0.796	S	S	*	*			trans	179.2	146.2	152.6	0	0	0	0	0	109.6
363	G	32.3	Very low	31.7	Very low	76 Å²	76	117 Å²	117	78%	0.784	80%	0.796	S	S	*	*			cis	162.7	92.4	-3.1	0	0	0	0	0	110
364	M	38.9	Very low	31.9	Very low	184 Å²	184	116.1 Å²	116.1	91%	0.906	80%	0.796	S	S	*	*			trans	-80.5	161.4	-178.4	-171.8	61.6	75.3	0	0	111.6
365	A	28.5	Very low	31.8	Very low	91 Å²	91	114.6 Å²	114.6	75%	0.752	79%	0.79	S	S	*	*			trans	77.4	152.9	166.4	0	0	0	0	0	117.1
366	A	32.5	Very low	31.9	Very low	80 Å²	80	119.2 Å²	119.2	66%	0.661	80%	0.796	S	S	*	*			cis	-173	-170.4	-22.9	0	0	0	0	0	109.3
367	L	31.5	Very low	31.8	Very low	162 Å²	162	116.2 Å²	116.2	85%	0.848	79%	0.79	S	S	*	*			trans	78	114.5	155.4	-47.4	-176.3	0	0	0	119.8
368	N	30.6	Very low	31.6	Very low	165 Å²	165	117 Å²	117	88%	0.882	79%	0.794	S	S	*	*				54.6	118.1	117.5	-169.9	41.8	0	0	0	122
369	G	28.9	Very low	31.2	Very low	70 Å²	70	114.2 Å²	114.2	72%	0.722	79%	0.79	S	S	*	*			trans	124.8	148.7	142.1	0	0	0	0	0	117.8
370	G	29.3	Very low	31.1	Very low	70 Å²	70	118 Å²	118	72%	0.722	80%	0.801	S	S	*	*			trans	111.2	123	177.7	0	0	0	0	0	113
371	L	32	Very low	30.8	Very low	184 Å²	184	115.9 Å²	115.9	96%	0.963	80%	0.797	S	S	*	*			cis	55.2	126.9	18.8	-67.5	165.3	0	0	0	114.1
372	G	28.1	Very low	30.5	Very low	69 Å²	69	113.5 Å²	113.5	71%	0.711	79%	0.794	S	S	*	*			cis	154.2	140.2	-9.8	0	0	0	0	0	113.8
373	S	33.8	Very low	30.4	Very low	115 Å²	115	114.8 Å²	114.8	80%	0.804	79%	0.792	S	S	*	*			trans	71.3	135	165.7	-166.7	0	0	0	0	120.3
374	S	30	Very low	30.5	Very low	116 Å²	116	119.6 Å²	119.6	81%	0.811	80%	0.796	S	S	*	*				135.6	135	126.5	-55.7	0	0	0	0	115.5
375	G	28.7	Very low	30.2	Very low	66 Å²	66	119.4 Å²	119.4	68%	0.68	79%	0.793	S	S	*	*			trans	104.9	93.4	176.9	0	0	0	0	0	113
376	L	30.8	Very low	30.3	Very low	170 Å²	170	119.5 Å²	119.5	89%	0.89	79%	0.793	S	S	*	*				65.2	128.8	59.3	-54.1	176.7	0	0	0	113
377	S	30.1	Very low	30.4	Very low	106 Å²	106	124.3 Å²	124.3	74%	0.741	81%	0.807	S	S	*	*			cis	-167	137.5	-2.8	46.9	0	0	0	0	114.4
378	N	29.1	Very low	31	Very low	164 Å²	164	123 Å²	123	88%	0.877	81%	0.806	S	S	*	*			trans	37.5	130.3	146.7	-158.6	55	0	0	0	122.4
379	G	27.8	Very low	31.7	Very low	63 Å²	63	124.3 Å²	124.3	65%	0.649	81%	0.807	S	S	*	*			trans	-173.1	42.5	177.8	0	0	0	0	0	120.1
380	T	29	Very low	31.8	Very low	140 Å²	140	125.5 Å²	125.5	86%	0.859	81%	0.81	S	S	*	*			trans	42.6	124.1	157	53.3	0	0	0	0	122.4
381	G	26.5	Very low	31.9	Very low	72 Å²	72	133 Å²	133	74%	0.742	82%	0.818	S	S	*	*			trans	149	109.2	143.6	0	0	0	0	0	120.1
382	S	28.5	Very low	31.9	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	82%	0.816	S	S	*	*			trans	63.4	107.8	139.7	-53.7	0	0	0	0	124.1
383	T	31	Very low	32	Very low	133 Å²	133	130.9 Å²	130.9	82%	0.816	82%	0.82	S	S	*	*				47.9	118.4	127.6	59.2	0	0	0	0	124.5
384	M	36	Very low	32.3	Very low	176 Å²	176	132.3 Å²	132.3	87%	0.867	82%	0.817	S	S	*	*			trans	71.1	163.9	131.8	-144.8	172.8	164.2	0	0	120.9
385	E	31	Very low	32.4	Very low	180 Å²	180	133.9 Å²	133.9	84%	0.841	81%	0.811	S	S	*	*			trans	66.4	83.1	164.4	-54.6	-171.8	106.3	0	0	119.5
386	A	31.1	Very low	32.6	Very low	93 Å²	93	138 Å²	138	77%	0.769	81%	0.813	S	S	*	*			trans	-154.6	21.5	172.1	0	0	0	0	0	118.4
387	L	33.9	Very low	32.6	Very low	181 Å²	181	139.6 Å²	139.6	95%	0.948	81%	0.809	S	S	*	*	S	Bend	trans	-132	46.8	175.9	-76.5	179	0	0	0	114
388	T	45.6	Very low	32.5	Very low	135 Å²	135	138.9 Å²	138.9	83%	0.828	81%	0.809	S	S	*	*			trans	-131	157	157.1	-75.1	0	0	0	0	107
389	Q	45.1	Very low	32.4	Very low	192 Å²	192	135.9 Å²	135.9	90%	0.897	81%	0.807	S	S	*	*			trans	80	62.2	-169.5	-49.7	-167.5	12.5	0	0	116.2
390	A	31.3	Very low	32.5	Very low	95 Å²	95	137.3 Å²	137.3	79%	0.785	81%	0.813	S	S	*	*	S	Bend	trans	-140.5	26.7	163.5	0	0	0	0	0	114.6
391	Y	30.3	Very low	32.4	Very low	229 Å²	229	135.4 Å²	135.4	90%	0.898	81%	0.811	S	S	*	*	S	Bend	trans	-165.4	104.2	164.1	-127.8	-87.5	0	0	0	111.9
392	S	31.3	Very low	32.5	Very low	130 Å²	130	140 Å²	140	91%	0.909	82%	0.818	S	S	*	*			trans	-173.8	143.9	165.8	-87.2	0	0	0	0	113.7
393	G	31.1	Very low	33.7	Very low	78 Å²	78	139.5 Å²	139.5	80%	0.804	81%	0.812	S	S	*	*			trans	93.7	140.9	173.5	0	0	0	0	0	114.7
394	I	39.8	Very low	33.6	Very low	145 Å²	145	138.6 Å²	138.6	74%	0.744	81%	0.807	S	S	*	*			cis	-166.6	158.2	-4.6	-155.2	173.8	0	0	0	106.9
395	Q	31.8	Very low	33.2	Very low	148 Å²	148	137.5 Å²	137.5	69%	0.692	80%	0.804	S	S	*	*			cis	-109.4	172.2	1	-78.9	-176.8	24.9	0	0	110.7
396	Q	33.4	Very low	33.2	Very low	154 Å²	154	138.9 Å²	138.9	72%	0.72	80%	0.803	S	S	*	*			cis	98.4	156.1	18	-69.6	-166.6	-19.5	0	0	117.8
397	Y	31.9	Very low	33.2	Very low	203 Å²	203	140.6 Å²	140.6	80%	0.796	80%	0.799	S	S	*	*			trans	76.1	127.7	-169.7	-65.3	-83.5	0	0	0	115.9
398	A	26.9	Very low	33	Very low	91 Å²	91	139.5 Å²	139.5	75%	0.752	79%	0.789	S	S	*	*			cis	-148.4	165.2	-1.9	0	0	0	0	0	115.1
399	A	27	Very low	32.1	Very low	100 Å²	100	138.5 Å²	138.5	83%	0.826	78%	0.778	S	S	*	*			trans	-41	171.4	174.9	0	0	0	0	0	117.7
400	A	29.1	Very low	31.3	Very low	93 Å²	93	137.7 Å²	137.7	77%	0.769	78%	0.779	S	S	*	*			cis	-158.9	175.4	20.8	0	0	0	0	0	115.2
401	A	28	Very low	31.4	Very low	101 Å²	101	140.1 Å²	140.1	84%	0.835	78%	0.778	S	S	*	*			trans	81	132	154.3	0	0	0	0	0	121.2
402	L	29.1	Very low	31.5	Very low	167 Å²	167	135.3 Å²	135.3	87%	0.874	77%	0.773	S	S	*	*			trans	-128.2	171.2	162.6	-90.1	173.4	0	0	0	106.4
403	P	53.4	Low	31.9	Very low	105 Å²	105	138.3 Å²	138.3	68%	0.682	77%	0.772	S	S	*	*			cis	-126.9	-159.9	-13.2	33.7	-13.7	0	0	0	111.7
404	T	28.2	Very low	32.1	Very low	115 Å²	115	143.3 Å²	143.3	71%	0.706	78%	0.775	S	S	*	*			trans	132.6	135.9	134.7	-52	0	0	0	0	116.2
405	L	27.2	Very low	31.7	Very low	153 Å²	153	142.1 Å²	142.1	80%	0.801	78%	0.779	S	S	*	*			trans	61.3	108	162.1	-78.3	167	0	0	0	122.4
406	Y	32.2	Very low	32.1	Very low	209 Å²	209	143.4 Å²	143.4	82%	0.82	79%	0.789	S	S	*	*				26.8	127.4	118.6	-162.7	-109.2	0	0	0	121.4
407	N	30.1	Very low	31.8	Very low	129 Å²	129	139.1 Å²	139.1	69%	0.69	79%	0.786	S	S	*	*			trans	104.2	137.2	150.3	-156.8	24.8	0	0	0	119.8
408	Q	30.2	Very low	31.8	Very low	157 Å²	157	134.8 Å²	134.8	73%	0.734	79%	0.792	S	S	*	*			trans	75.2	136.6	154	-106	-77.4	73.7	0	0	121.5
409	N	27.5	Very low	31.8	Very low	115 Å²	115	134.4 Å²	134.4	62%	0.615	79%	0.79	S	S	*	*			trans	63.7	100	161.2	-159.5	11.9	0	0	0	119.6	L411	N409-L411 PolarHBondContact OD1-N 3.26Å
410	L	27.6	Very low	32.2	Very low	174 Å²	174	133.3 Å²	133.3	91%	0.911	79%	0.788	S	S	*	*			trans	-132.9	65	148.7	-158.7	81.7	0	0	0	110.6
411	L	32.5	Very low	32.7	Very low	146 Å²	146	134.2 Å²	134.2	76%	0.764	79%	0.789	S	S	*	*			trans	-102.7	145.7	169.4	-132.9	77.4	0	0	0	111.8	N409	N409-L411 PolarHBondContact OD1-N 3.26Å
412	T	33	Very low	33.9	Very low	128 Å²	128	132.9 Å²	132.9	79%	0.785	77%	0.765	S	S	*	*			trans	74.3	131.7	-165.8	74.7	0	0	0	0	113.9
413	Q	39	Very low	35.4	Very low	193 Å²	193	132.6 Å²	132.6	90%	0.902	76%	0.757	S	S	*	*			cis	-130.2	67.2	21.2	-161.4	179	109.2	0	0	114
414	Q	37.2	Very low	36	Very low	184 Å²	184	132.7 Å²	132.7	86%	0.86	75%	0.748	S	S	*	*	S	Bend	trans	-90.6	125.3	156.6	-87.5	-173.8	-21.8	0	0	110	I416	Q414-I416 PolarHBondContact O-N 3.21Å; Q414-I416 VanDerWaalsContact O-N 3.09Å
415	S	30.6	Very low	37.8	Very low	119 Å²	119	128 Å²	128	83%	0.832	72%	0.723	S	S	*	*			trans	-81.1	86.7	-173.3	59.9	0	0	0	0	112.5	G417	S415-G417 VanDerWaalsContact C-N 3.25Å; S415-G417 PolarHBondContact O-N 3.4Å
416	I	40.4	Very low	40.1	Very low	175 Å²	175	123.9 Å²	123.9	90%	0.897	71%	0.705	S	S	*	*			trans	-77.8	81.5	164.7	-57.3	177.6	0	0	0	108	Q414	Q414-I416 PolarHBondContact O-N 3.21Å; Q414-I416 VanDerWaalsContact O-N 3.09Å
417	G	27.8	Very low	41.9	Very low	64 Å²	64	120.2 Å²	120.2	66%	0.66	70%	0.696	S	S	*	*			trans	-114.9	128.7	176.2	0	0	0	0	0	111	S415 A419	S415-G417 VanDerWaalsContact C-N 3.25Å; S415-G417 PolarHBondContact O-N 3.4Å; G417-A419 PolarHBondContact O-N 2.95Å
418	A	30.9	Very low	44.1	Very low	112 Å²	112	115.2 Å²	115.2	93%	0.926	67%	0.674	S	S	*	*			trans	-78.9	106.2	-168.7	0	0	0	0	0	113.7
419	A	27.7	Very low	46.6	Very low	84 Å²	84	107.8 Å²	107.8	69%	0.694	64%	0.639	S	S	*	*			trans	-170.1	102.2	150.2	0	0	0	0	0	113	G417 S421	G417-A419 PolarHBondContact O-N 2.95Å; A419-S421 VanDerWaalsContact C-N 3.26Å; A419-S421 PolarHBondContact O-N 3.26Å
420	G	35.6	Very low	49.6	Very low	76 Å²	76	103.1 Å²	103.1	78%	0.784	62%	0.615	S	S	*	*			trans	53.2	-26.2	140.2	0	0	0	0	0	124	Q422	G420-Q422 PolarHBondContact O-N 2.57Å; G420-Q422 VanDerWaalsContact O-N 3.08Å
421	S	38	Very low	52.5	Low	113 Å²	113	94.8 Å²	94.8	79%	0.79	57%	0.571	S	S	*	*			trans	-76	96.8	-167.4	-66.1	0	0	0	0	112	A419 K423	A419-S421 VanDerWaalsContact C-N 3.26Å; A419-S421 PolarHBondContact O-N 3.26Å; S421-K423 PolarHBondContact O-N 3.02Å; S421-K423 VanDerWaalsContact O-N 3.14Å
422	Q	54.5	Low	55.3	Low	73 Å²	73	89.7 Å²	89.7	34%	0.341	54%	0.543	S	S	.	.			trans	-61.8	113.6	167.1	-60.3	-171.3	-89.9	0	0	108.7	G420 E424	G420-Q422 PolarHBondContact O-N 2.57Å; G420-Q422 VanDerWaalsContact O-N 3.08Å; Q422-E424 VanDerWaalsContact C-N 3.34Å; Q422-E424 HydrophobicContact CB-CG 4.36Å; Q422-E424 PolarHBondContact O-N 3.1Å
423	K	59.1	Low	58	Low	161 Å²	161	83.6 Å²	83.6	70%	0.7	51%	0.505	S	S	*	.			trans	-75.1	93	166.3	-76.9	-175.1	176.6	178.4	0	107.7	S421 V456 S457	S421-K423 PolarHBondContact O-N 3.02Å; S421-K423 VanDerWaalsContact O-N 3.14Å; K423-V456 HydrophobicContact CB-CG1 4.04Å; K423-V456 WeakPolarHBondContact O-CG1 3.1Å; K423-S457 WeakPolarHBondContact O-CB 3.48Å
424	E	66.1	Low	60.3	Low	106 Å²	106	78.2 Å²	78.2	50%	0.495	48%	0.477	S	S	.	.			trans	-76.7	122.8	170.2	-57.6	-165.4	72.1	0	0	108.7	Q422 K505	Q422-E424 VanDerWaalsContact C-N 3.34Å; Q422-E424 HydrophobicContact CB-CG 4.36Å; Q422-E424 PolarHBondContact O-N 3.1Å; E424-K505 IonicContact OE1-NZ 3.69Å; E424-K505 PolarHBondContact OE1-NZ 3.16Å; E424-K505 IonicContact OE2-NZ 3.37Å
425	G	67.1	Low	62.5	Low	17 Å²	17	73.6 Å²	73.6	18%	0.175	46%	0.456	C	S	.	.			trans	-66.2	-176.2	165	0	0	0	0	0	112	N430 S476	G425-N430 PolarHBondContact O-ND2 3.14Å; G425-S476 PolarHBondContact N-OG 3.31Å
426	P	75.2	Confident	65.2	Low	66 Å²	66	68 Å²	68	43%	0.429	42%	0.416	S	S	.	.	S	Bend	trans	-59	159	-170.3	20.9	-30.5	0	0	0	114.3	G428 A429 N430 D478	P426-G428 PolarHBondContact O-N 3.31Å; P426-A429 HydrophobicContact CG-CB 3.87Å; P426-A429 WeakPolarHBondContact O-CB 3.35Å; P426-A429 PolarHBondContact O-N 3.25Å; P426-N430 PolarHBondContact O-ND2 3.36Å; P426-N430 VanDerWaalsContact O-ND2 3.09Å; P426-D478 WeakPolarHBondContact CD-O 3.39Å; P426-D478 WeakPolarHBondContact CG-O 3.33Å
427	E	70.3	Confident	67.1	Low	133 Å²	133	61 Å²	61	62%	0.621	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	132.3	172.6	-168.9	166.9	178	0	0	109.6	S507	E427-S507 WeakPolarHBondContact OE1-CB 3.37Å; E427-S507 PolarHBondContact OE1-OG 3.37Å
428	G	75.7	Confident	69.5	Low	24 Å²	24	63.2 Å²	63.2	25%	0.247	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	-11.1	-169.5	0	0	0	0	0	115.9	P426 P480 L504	P426-G428 PolarHBondContact O-N 3.31Å; G428-P480 WeakPolarHBondContact O-CB 3.05Å; G428-L504 WeakPolarHBondContact O-CD1 3.29Å
429	A	83.7	Confident	71.9	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	37%	0.372	C	S	.	.			trans	-100.8	0.5	176.6	0	0	0	0	0	114.6	P426 Y477 P480	P426-A429 HydrophobicContact CG-CB 3.87Å; P426-A429 WeakPolarHBondContact O-CB 3.35Å; P426-A429 PolarHBondContact O-N 3.25Å; A429-Y477 VanDerWaalsContact CB-O 3.27Å; A429-Y477 WeakPolarHBondContact CB-O 3.47Å; A429-Y477 PolarHBondContact O-N 3.34Å; A429-P480 HydrophobicContact CB-CB 4.49Å
430	N	89.5	Confident	74.4	Confident	17 Å²	17	64.5 Å²	64.5	9%	0.091	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.8	-177.4	-72.1	-88.3	0	0	0	111.2	G425 P426 S476 L504 K505	G425-N430 PolarHBondContact O-ND2 3.14Å; P426-N430 PolarHBondContact O-ND2 3.36Å; P426-N430 VanDerWaalsContact O-ND2 3.09Å; N430-S476 WeakPolarHBondContact OD1-CB 3.28Å; N430-S476 PolarHBondContact OD1-OG 2.84Å; N430-L504 VanDerWaalsContact O-CD1 3.3Å; N430-L504 WeakPolarHBondContact O-CD1 3.34Å; N430-K505 HydrophobicContact CB-CB 3.91Å; N430-K505 HydrophobicContact CB-CD 4Å; N430-K505 VanDerWaalsContact O-CB 3.31Å; N430-K505 WeakPolarHBondContact O-CB 3.4Å; N430-K505 PolarHBondContact O-N 3.15Å
431	L	89.3	Confident	76.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	153.9	179.5	-58.8	-170.5	0	0	0	112.4	I433 F449 F474 V475 Y477 A483 A486 I487 V502 Q503 L504	L431-I433 HydrophobicContact CB-CD1 4.18Å; L431-F449 HydrophobicContact CD1-CD1 4.41Å; L431-F449 HydrophobicContact CD1-CE1 4.2Å; L431-F474 WeakPolarHBondContact O-CA 3.01Å; L431-V475 WeakPolarHBondContact CA-O 3.36Å; L431-V475 HydrophobicContact CB-CB 4.45Å; L431-V475 WeakPolarHBondContact CB-O 3.49Å; L431-V475 PolarHBondContact N-O 3.07Å; L431-V475 PolarHBondContact O-N 3.33Å; L431-Y477 HydrophobicContact CD1-CD2 4.27Å; L431-Y477 HydrophobicContact CD1-CE2 3.71Å; L431-Y477 HydrophobicContact CG-CD2 4.43Å; L431-Y477 HydrophobicContact CG-CE2 4.34Å; L431-A483 HydrophobicContact CD2-CB 3.89Å; L431-A483 HydrophobicContact CG-CB 4.16Å; L431-A486 HydrophobicContact CD1-CB 3.84Å; L431-I487 HydrophobicContact CD1-CG1 4.33Å; L431-I487 HydrophobicContact CD2-CD1 3.52Å; L431-I487 HydrophobicContact CD2-CG1 3.59Å; L431-V502 HydrophobicContact CB-CG1 4.48Å; L431-V502 HydrophobicContact CD1-CG1 3.8Å; L431-Q503 CarbonylContact C-O 3.5Å; L431-Q503 WeakPolarHBondContact CA-O 3.42Å; L431-L504 HydrophobicContact CD2-CD1 4.25Å
432	F	90.1	Very high	79	Confident	38 Å²	38	60 Å²	60	17%	0.167	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.3	170.3	-166.4	-142.4	0	0	0	109.7	Y434 F472 G473 F474 Q503 K505	F432-Y434 HydrophobicContact CD1-CD2 4.41Å; F432-Y434 HydrophobicContact CD1-CE1 4.06Å; F432-Y434 AromaticContact CD1-CE2 3.63Å; F432-Y434 HydrophobicContact CD1-CE2 3.63Å; F432-Y434 AromaticContact CD1-CZ 3.44Å; F432-Y434 VanDerWaalsContact CD1-CZ 3.44Å; F432-Y434 WeakPolarHBondContact CD1-OH 3.37Å; F432-Y434 HydrophobicContact CE1-CD1 4.26Å; F432-Y434 AromaticContact CE1-CE1 3.47Å; F432-Y434 HydrophobicContact CE1-CE1 3.47Å; F432-Y434 VanDerWaalsContact CE1-CE1 3.47Å; F432-Y434 AromaticContact CE1-CE2 3.94Å; F432-Y434 HydrophobicContact CE1-CE2 3.94Å; F432-Y434 AromaticContact CE1-CZ 3.29Å; F432-Y434 WeakPolarHBondContact CE1-OH 3.14Å; F432-Y434 HydrophobicContact CG-CE2 4.45Å; F432-Y434 HydrophobicContact CZ-CE1 4.14Å; F432-F472 HydrophobicContact CE2-CB 4.38Å; F432-F472 AromaticContact CE2-CD2 3.63Å; F432-F472 HydrophobicContact CE2-CD2 3.63Å; F432-F472 HydrophobicContact CE2-CE2 4.28Å; F432-F472 HydrophobicContact CE2-CG 4.33Å; F432-F472 HydrophobicContact CZ-CB 4.44Å; F432-F472 AromaticContact CZ-CD2 3.82Å; F432-F472 HydrophobicContact CZ-CD2 3.82Å; F432-F472 HydrophobicContact CZ-CE2 4.32Å; F432-F472 HydrophobicContact CZ-CG 4.27Å; F432-G473 WeakPolarHBondContact CD2-O 3.29Å; F432-F474 HydrophobicContact CB-CD1 4.37Å; F432-F474 HydrophobicContact CB-CE1 4.5Å; F432-F474 AromaticContact CD2-CD1 3.39Å; F432-F474 HydrophobicContact CD2-CD1 3.39Å; F432-F474 HydrophobicContact CD2-CD2 4.12Å; F432-F474 AromaticContact CD2-CE1 3.24Å; F432-F474 HydrophobicContact CD2-CE1 3.24Å; F432-F474 AromaticContact CD2-CE2 4Å; F432-F474 HydrophobicContact CD2-CE2 4Å; F432-F474 AromaticContact CD2-CG 3.86Å; F432-F474 HydrophobicContact CD2-CG 3.86Å; F432-F474 AromaticContact CD2-CZ 3.58Å; F432-F474 HydrophobicContact CD2-CZ 3.58Å; F432-F474 AromaticContact CE2-CD1 3.97Å; F432-F474 HydrophobicContact CE2-CD1 3.97Å; F432-F474 HydrophobicContact CE2-CD2 4.05Å; F432-F474 AromaticContact CE2-CE1 3.47Å; F432-F474 HydrophobicContact CE2-CE1 3.47Å; F432-F474 VanDerWaalsContact CE2-CE1 3.47Å; F432-F474 AromaticContact CE2-CE2 3.55Å; F432-F474 HydrophobicContact CE2-CE2 3.55Å; F432-F474 HydrophobicContact CE2-CG 4.26Å; F432-F474 AromaticContact CE2-CZ 3.24Å; F432-F474 HydrophobicContact CE2-CZ 3.24Å; F432-F474 HydrophobicContact CG-CD1 4.16Å; F432-F474 AromaticContact CG-CE1 3.94Å; F432-F474 HydrophobicContact CG-CE1 3.94Å; F432-F474 HydrophobicContact CZ-CE1 4.29Å; F432-F474 AromaticContact CZ-CZ 3.97Å; F432-F474 HydrophobicContact CZ-CZ 3.97Å; F432-Q503 PolarHBondContact N-O 3.44Å; F432-Q503 PolarHBondContact O-N 2.8Å; F432-K505 HydrophobicContact CB-CB 4.47Å
433	I	90.4	Very high	80.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.1	-172	-53.7	83	0	0	0	108.4	L431 L436 L445 F449 F472 G473 V475 L500 K501 V502	L431-I433 HydrophobicContact CB-CD1 4.18Å; I433-L436 HydrophobicContact CG2-CD2 3.75Å; I433-L436 HydrophobicContact CG2-CG 3.99Å; I433-L445 HydrophobicContact CD1-CD1 4.4Å; I433-L445 HydrophobicContact CG1-CD1 4.41Å; I433-F449 HydrophobicContact CD1-CZ 4.46Å; I433-F449 HydrophobicContact CG1-CE1 4.17Å; I433-F449 HydrophobicContact CG1-CE2 4.37Å; I433-F449 HydrophobicContact CG1-CZ 3.74Å; I433-F472 CarbonylContact O-C 3.52Å; I433-F472 WeakPolarHBondContact O-CA 3.44Å; I433-F472 WeakPolarHBondContact O-CB 3.37Å; I433-G473 PolarHBondContact N-O 3.45Å; I433-G473 PolarHBondContact O-N 3Å; I433-V475 HydrophobicContact CD1-CB 3.91Å; I433-V475 HydrophobicContact CD1-CG2 3.68Å; I433-L500 HydrophobicContact CG2-CD2 4.38Å; I433-K501 WeakPolarHBondContact CA-O 3.39Å; I433-V502 HydrophobicContact CG1-CG1 4.34Å; I433-V502 HydrophobicContact CG1-CG2 4.16Å; I433-V502 HydrophobicContact CG2-CG2 4.14Å
434	Y	86.9	Confident	81.7	Confident	81 Å²	81	58.1 Å²	58.1	32%	0.318	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	162.2	171.9	-50.2	-103.9	0	0	0	111.3	F432 L436 C471 K501	F432-Y434 HydrophobicContact CD1-CD2 4.41Å; F432-Y434 HydrophobicContact CD1-CE1 4.06Å; F432-Y434 AromaticContact CD1-CE2 3.63Å; F432-Y434 HydrophobicContact CD1-CE2 3.63Å; F432-Y434 AromaticContact CD1-CZ 3.44Å; F432-Y434 VanDerWaalsContact CD1-CZ 3.44Å; F432-Y434 WeakPolarHBondContact CD1-OH 3.37Å; F432-Y434 HydrophobicContact CE1-CD1 4.26Å; F432-Y434 AromaticContact CE1-CE1 3.47Å; F432-Y434 HydrophobicContact CE1-CE1 3.47Å; F432-Y434 VanDerWaalsContact CE1-CE1 3.47Å; F432-Y434 AromaticContact CE1-CE2 3.94Å; F432-Y434 HydrophobicContact CE1-CE2 3.94Å; F432-Y434 AromaticContact CE1-CZ 3.29Å; F432-Y434 WeakPolarHBondContact CE1-OH 3.14Å; F432-Y434 HydrophobicContact CG-CE2 4.45Å; F432-Y434 HydrophobicContact CZ-CE1 4.14Å; Y434-L436 VanDerWaalsContact C-N 3.31Å; Y434-C471 CarbonylContact C-O 3.54Å; Y434-K501 HydrophobicContact CD2-CB 4.35Å; Y434-K501 HydrophobicContact CD2-CD 4.25Å; Y434-K501 HydrophobicContact CD2-CG 4.37Å; Y434-K501 PolarHBondContact N-O 2.84Å; Y434-K501 PolarHBondContact O-N 3.2Å
435	H	84.8	Confident	82.8	Confident	87 Å²	87	53 Å²	53	40%	0.403	27%	0.273	S	S	.	.	S	Bend	trans	65.1	27.5	179.2	-45.6	154.1	0	0	0	114.7	C471 K498 R499	H435-C471 WeakPolarHBondContact CA-O 3.43Å; H435-C471 PolarHBondContact N-O 3.49Å; H435-K498 HydrophobicContact CB-CB 4.2Å; H435-K498 HydrophobicContact CB-CD 4.31Å; H435-R499 WeakPolarHBondContact CB-O 3.29Å; H435-R499 PolarHBondContact ND1-O 3.39Å
436	L	85.9	Confident	83.7	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	28%	0.276	C	S	.	.			trans	-55.6	145.1	167	-67.2	172.9	0	0	0	110.1	I433 Y434 F440 L445 V460 C471 L500	I433-L436 HydrophobicContact CG2-CD2 3.75Å; I433-L436 HydrophobicContact CG2-CG 3.99Å; Y434-L436 VanDerWaalsContact C-N 3.31Å; L436-F440 HydrophobicContact CD2-CD1 4.43Å; L436-L445 HydrophobicContact CD1-CD1 4.22Å; L436-L445 HydrophobicContact CD1-CD2 4.33Å; L436-L445 HydrophobicContact CD2-CD1 3.94Å; L436-V460 HydrophobicContact CD1-CG1 4.47Å; L436-V460 HydrophobicContact CD1-CG2 3.94Å; L436-C471 PolarHBondContact N-O 3.44Å; L436-C471 WeakPolarHBondContact O-CA 3.44Å; L436-C471 VanDerWaalsContact O-CB 3.26Å; L436-C471 WeakPolarHBondContact O-CB 3.45Å; L436-L500 HydrophobicContact CD2-CD2 3.86Å
437	P	81.3	Confident	84.2	Confident	28 Å²	28	57.5 Å²	57.5	18%	0.182	29%	0.285	C	S	.	.			trans	-55.8	154.9	169.7	-24.5	34.7	0	0	0	112	E439 F440 I495	P437-E439 PolarHBondContact O-N 2.91Å; P437-F440 HydrophobicContact CB-CB 4.47Å; P437-F440 HydrophobicContact CB-CD2 3.72Å; P437-F440 HydrophobicContact CB-CE2 4.37Å; P437-F440 HydrophobicContact CB-CG 4.3Å; P437-F440 HydrophobicContact CG-CD2 3.61Å; P437-F440 HydrophobicContact CG-CE2 3.9Å; P437-F440 HydrophobicContact CG-CG 4.12Å; P437-F440 PolarHBondContact O-N 3.2Å; P437-I495 HydrophobicContact CG-CB 4.48Å; P437-I495 HydrophobicContact CG-CD1 3.88Å; P437-I495 HydrophobicContact CG-CG1 3.84Å; P437-I495 HydrophobicContact CG-CG2 3.87Å
438	Q	77.6	Confident	84.9	Confident	111 Å²	111	53 Å²	53	52%	0.519	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.6	-177.3	-164.2	162.6	-19.3	0	0	112.9	L468 S469	Q438-L468 HydrophobicContact CG-CB 4.19Å; Q438-L468 HydrophobicContact CG-CD2 4.38Å; Q438-S469 VanDerWaalsContact O-CB 3.26Å; Q438-S469 WeakPolarHBondContact O-CB 3.26Å
439	E	81.1	Confident	85.4	Confident	182 Å²	182	51.9 Å²	51.9	85%	0.85	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-10.7	-179	-58.4	169.5	121.8	0	0	113.3	P437 G441	P437-E439 PolarHBondContact O-N 2.91Å; E439-G441 PolarHBondContact O-N 3.48Å
440	F	79.4	Confident	85.5	Confident	41 Å²	41	56.6 Å²	56.6	18%	0.18	28%	0.276	C	S	.	.			trans	-77.3	122.3	-176.7	-98.9	-124.6	0	0	0	111.8	L436 P437 D444 M448 I495	L436-F440 HydrophobicContact CD2-CD1 4.43Å; P437-F440 HydrophobicContact CB-CB 4.47Å; P437-F440 HydrophobicContact CB-CD2 3.72Å; P437-F440 HydrophobicContact CB-CE2 4.37Å; P437-F440 HydrophobicContact CB-CG 4.3Å; P437-F440 HydrophobicContact CG-CD2 3.61Å; P437-F440 HydrophobicContact CG-CE2 3.9Å; P437-F440 HydrophobicContact CG-CG 4.12Å; P437-F440 PolarHBondContact O-N 3.2Å; F440-D444 HydrophobicContact CD1-CB 3.7Å; F440-D444 HydrophobicContact CE1-CB 3.83Å; F440-D444 HydrophobicContact CG-CB 4.08Å; F440-D444 HydrophobicContact CZ-CB 4.33Å; F440-M448 HydrophobicContact CE1-CE 3.48Å; F440-M448 VanDerWaalsContact CE1-CE 3.48Å; F440-M448 HydrophobicContact CE1-SD 4.08Å; F440-M448 HydrophobicContact CZ-CE 3.74Å; F440-I495 HydrophobicContact CE1-CD1 4.12Å; F440-I495 HydrophobicContact CE2-CD1 3.75Å; F440-I495 HydrophobicContact CZ-CD1 3.42Å; F440-I495 VanDerWaalsContact CZ-CD1 3.42Å
441	G	83.8	Confident	85.4	Confident	18 Å²	18	60.6 Å²	60.6	19%	0.186	30%	0.303	C	S	.	.			trans	-97.5	-175.9	173.3	0	0	0	0	0	113.8	E439 Q443 D444 L445 V460	E439-G441 PolarHBondContact O-N 3.48Å; G441-Q443 PolarHBondContact O-N 3.28Å; G441-D444 WeakPolarHBondContact CA-OD2 3.29Å; G441-D444 PolarHBondContact N-OD2 3.38Å; G441-D444 PolarHBondContact O-N 2.95Å; G441-L445 WeakPolarHBondContact O-CB 3.26Å; G441-L445 PolarHBondContact O-N 3.44Å; G441-L445 VanDerWaalsContact O-N 3.15Å; G441-V460 VanDerWaalsContact C-CG2 3.5Å; G441-V460 WeakPolarHBondContact O-CG2 3.45Å
442	D	86.4	Confident	85.2	Confident	75 Å²	75	63.1 Å²	63.1	40%	0.401	31%	0.314	S	S	.	.	H	α-helix	trans	-60	-35.7	178.8	-51.7	-72.3	0	0	0	112.4	L446 K459 V460	D442-L446 WeakPolarHBondContact O-CB 3.39Å; D442-L446 PolarHBondContact O-N 2.92Å; D442-K459 VanDerWaalsContact OD1-CA 3.23Å; D442-K459 WeakPolarHBondContact OD1-CA 3.43Å; D442-V460 PolarHBondContact OD1-N 2.94Å
443	Q	85.5	Confident	84.9	Confident	122 Å²	122	62.2 Å²	62.2	57%	0.57	32%	0.315	S	S	*	.	H	α-helix	trans	-72.8	-39.8	-177	-175.6	57.5	81.8	0	0	112.5	G441 L446 Q447	G441-Q443 PolarHBondContact O-N 3.28Å; Q443-L446 PolarHBondContact O-N 2.73Å; Q443-Q447 WeakPolarHBondContact O-CB 3.39Å; Q443-Q447 PolarHBondContact O-N 2.95Å
444	D	86.6	Confident	84.7	Confident	73 Å²	73	67 Å²	67	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-69.3	-41.4	176.9	-44.8	-73.9	0	0	0	110.6	F440 G441 L446 Q447 M448	F440-D444 HydrophobicContact CD1-CB 3.7Å; F440-D444 HydrophobicContact CE1-CB 3.83Å; F440-D444 HydrophobicContact CG-CB 4.08Å; F440-D444 HydrophobicContact CZ-CB 4.33Å; G441-D444 WeakPolarHBondContact CA-OD2 3.29Å; G441-D444 PolarHBondContact N-OD2 3.38Å; G441-D444 PolarHBondContact O-N 2.95Å; D444-L446 VanDerWaalsContact C-N 3.32Å; D444-L446 PolarHBondContact O-N 3.36Å; D444-Q447 PolarHBondContact O-N 2.83Å; D444-M448 VanDerWaalsContact O-CB 3.23Å; D444-M448 WeakPolarHBondContact O-CB 3.35Å; D444-M448 PolarHBondContact O-N 2.84Å
445	L	87.3	Confident	84.8	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-40.2	173.6	-177.8	63.5	0	0	0	111.4	I433 L436 G441 F449 A458 V460 V475	I433-L445 HydrophobicContact CD1-CD1 4.4Å; I433-L445 HydrophobicContact CG1-CD1 4.41Å; L436-L445 HydrophobicContact CD1-CD1 4.22Å; L436-L445 HydrophobicContact CD1-CD2 4.33Å; L436-L445 HydrophobicContact CD2-CD1 3.94Å; G441-L445 WeakPolarHBondContact O-CB 3.26Å; G441-L445 PolarHBondContact O-N 3.44Å; G441-L445 VanDerWaalsContact O-N 3.15Å; L445-F449 HydrophobicContact CD1-CD2 3.83Å; L445-F449 HydrophobicContact CD1-CE2 3.74Å; L445-F449 WeakPolarHBondContact O-CB 3.4Å; L445-F449 VanDerWaalsContact O-CD2 3.27Å; L445-F449 WeakPolarHBondContact O-CD2 3.41Å; L445-F449 PolarHBondContact O-N 2.98Å; L445-A458 HydrophobicContact CD2-CB 4.37Å; L445-A458 HydrophobicContact CG-CB 4.31Å; L445-V460 HydrophobicContact CB-CG2 3.99Å; L445-V460 HydrophobicContact CD2-CG2 3.72Å; L445-V460 HydrophobicContact CG-CG2 4.46Å; L445-V475 HydrophobicContact CD1-CG2 3.82Å; L445-V475 HydrophobicContact CD2-CG2 3.87Å; L445-V475 HydrophobicContact CG-CG2 3.61Å
446	L	87.2	Confident	84.9	Confident	46 Å²	46	62.6 Å²	62.6	24%	0.241	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-51.2	174	-171.7	141	0	0	0	111.2	D442 Q443 D444 M448 F449 M450 V455 A458	D442-L446 WeakPolarHBondContact O-CB 3.39Å; D442-L446 PolarHBondContact O-N 2.92Å; Q443-L446 PolarHBondContact O-N 2.73Å; D444-L446 VanDerWaalsContact C-N 3.32Å; D444-L446 PolarHBondContact O-N 3.36Å; L446-M448 VanDerWaalsContact C-N 3.31Å; L446-M448 PolarHBondContact O-N 3.02Å; L446-F449 PolarHBondContact O-N 3.08Å; L446-M450 HydrophobicContact CD2-CE 4.01Å; L446-M450 HydrophobicContact CD2-CG 3.75Å; L446-M450 HydrophobicContact CD2-SD 3.73Å; L446-M450 HydrophobicContact CG-CG 4.4Å; L446-M450 WeakPolarHBondContact O-CG 3.22Å; L446-M450 PolarHBondContact O-N 3.48Å; L446-V455 HydrophobicContact CD1-CG1 4.1Å; L446-V455 HydrophobicContact CG-CB 4.4Å; L446-V455 HydrophobicContact CG-CG1 4.2Å; L446-A458 HydrophobicContact CB-CB 3.8Å; L446-A458 HydrophobicContact CD1-CB 4.29Å; L446-A458 HydrophobicContact CG-CB 4.44Å
447	Q	86	Confident	84.7	Confident	131 Å²	131	64 Å²	64	61%	0.612	34%	0.338	S	S	*	.	H	α-helix	trans	-62	-36.8	-177.2	-173.8	169.4	-58.7	0	0	112.9	Q443 D444 F449 M450	Q443-Q447 WeakPolarHBondContact O-CB 3.39Å; Q443-Q447 PolarHBondContact O-N 2.95Å; D444-Q447 PolarHBondContact O-N 2.83Å; Q447-F449 VanDerWaalsContact C-N 3.32Å; Q447-F449 PolarHBondContact O-N 3.12Å; Q447-M450 HydrophobicContact CB-CE 4.32Å; Q447-M450 HydrophobicContact CG-CE 4.25Å
448	M	84.6	Confident	85	Confident	39 Å²	39	63.5 Å²	63.5	19%	0.192	34%	0.336	C	S	.	.	H	α-helix	trans	-66.6	-30.3	174.4	176.1	175.5	-80	0	0	113.3	F440 D444 L446 F452 M490 I495 L500	F440-M448 HydrophobicContact CE1-CE 3.48Å; F440-M448 VanDerWaalsContact CE1-CE 3.48Å; F440-M448 HydrophobicContact CE1-SD 4.08Å; F440-M448 HydrophobicContact CZ-CE 3.74Å; D444-M448 VanDerWaalsContact O-CB 3.23Å; D444-M448 WeakPolarHBondContact O-CB 3.35Å; D444-M448 PolarHBondContact O-N 2.84Å; L446-M448 VanDerWaalsContact C-N 3.31Å; L446-M448 PolarHBondContact O-N 3.02Å; M448-F452 WeakPolarHBondContact O-CE2 3.46Å; M448-M490 HydrophobicContact CE-CE 4.37Å; M448-M490 HydrophobicContact CG-CE 3.52Å; M448-M490 HydrophobicContact SD-CE 3.51Å; M448-M490 VanDerWaalsContact SD-CE 3.51Å; M448-I495 HydrophobicContact CE-CD1 3.65Å; M448-L500 HydrophobicContact SD-CD1 3.8Å
449	F	86.1	Confident	85.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-101.6	-16.1	-173.8	-81.4	-104.6	0	0	0	114.2	L431 I433 L445 L446 Q447 P451 F452 V455 V475 Y477 A486 M490 V502	L431-F449 HydrophobicContact CD1-CD1 4.41Å; L431-F449 HydrophobicContact CD1-CE1 4.2Å; I433-F449 HydrophobicContact CD1-CZ 4.46Å; I433-F449 HydrophobicContact CG1-CE1 4.17Å; I433-F449 HydrophobicContact CG1-CE2 4.37Å; I433-F449 HydrophobicContact CG1-CZ 3.74Å; L445-F449 HydrophobicContact CD1-CD2 3.83Å; L445-F449 HydrophobicContact CD1-CE2 3.74Å; L445-F449 WeakPolarHBondContact O-CB 3.4Å; L445-F449 VanDerWaalsContact O-CD2 3.27Å; L445-F449 WeakPolarHBondContact O-CD2 3.41Å; L445-F449 PolarHBondContact O-N 2.98Å; L446-F449 PolarHBondContact O-N 3.08Å; Q447-F449 VanDerWaalsContact C-N 3.32Å; Q447-F449 PolarHBondContact O-N 3.12Å; F449-P451 VanDerWaalsContact C-CD 3.45Å; F449-F452 PolarHBondContact O-N 2.61Å; F449-V455 HydrophobicContact CB-CG2 4.16Å; F449-V475 HydrophobicContact CB-CG1 3.99Å; F449-V475 HydrophobicContact CB-CG2 4.24Å; F449-V475 HydrophobicContact CD1-CB 4.33Å; F449-V475 HydrophobicContact CD1-CG1 4.14Å; F449-V475 HydrophobicContact CD1-CG2 4.17Å; F449-V475 HydrophobicContact CD2-CG2 4.28Å; F449-V475 HydrophobicContact CG-CG1 4.24Å; F449-V475 HydrophobicContact CG-CG2 3.96Å; F449-Y477 WeakPolarHBondContact CB-OH 3.48Å; F449-Y477 HydrophobicContact CD1-CE2 4.41Å; F449-Y477 WeakPolarHBondContact CD1-OH 3.43Å; F449-Y477 PolarHBondContact O-OH 2.99Å; F449-A486 HydrophobicContact CD1-CB 4.19Å; F449-A486 HydrophobicContact CE1-CB 4.37Å; F449-M490 HydrophobicContact CE1-CB 4.23Å; F449-M490 HydrophobicContact CE1-CG 4.24Å; F449-M490 HydrophobicContact CE2-CE 4.43Å; F449-M490 HydrophobicContact CZ-CB 4Å; F449-M490 HydrophobicContact CZ-CG 4.15Å; F449-V502 HydrophobicContact CE1-CG1 4.18Å; F449-V502 HydrophobicContact CE1-CG2 4.33Å; F449-V502 HydrophobicContact CZ-CG2 3.93Å
450	M	85.4	Confident	85.9	Confident	98 Å²	98	53.4 Å²	53.4	48%	0.483	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-50.2	-43.5	171	-80.6	-160.5	-67.8	0	0	116	L446 Q447 F452 G453	L446-M450 HydrophobicContact CD2-CE 4.01Å; L446-M450 HydrophobicContact CD2-CG 3.75Å; L446-M450 HydrophobicContact CD2-SD 3.73Å; L446-M450 HydrophobicContact CG-CG 4.4Å; L446-M450 WeakPolarHBondContact O-CG 3.22Å; L446-M450 PolarHBondContact O-N 3.48Å; Q447-M450 HydrophobicContact CB-CE 4.32Å; Q447-M450 HydrophobicContact CG-CE 4.25Å; M450-F452 PolarHBondContact O-N 2.88Å; M450-F452 VanDerWaalsContact O-N 3.09Å; M450-G453 PolarHBondContact O-N 3.39Å; M450-G453 VanDerWaalsContact O-N 3.09Å
451	P	87.6	Confident	86.1	Confident	101 Å²	101	54.6 Å²	54.6	66%	0.656	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-67.1	-13.1	-175.3	24.8	-34.4	0	0	0	114.4	F449	F449-P451 VanDerWaalsContact C-CD 3.45Å
452	F	84.7	Confident	86.1	Confident	54 Å²	54	57.5 Å²	57.5	24%	0.237	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-95.9	-7.3	176.8	-50.3	-74.1	0	0	0	113.2	M448 F449 M450 S482 A486 M490	M448-F452 WeakPolarHBondContact O-CE2 3.46Å; F449-F452 PolarHBondContact O-N 2.61Å; M450-F452 PolarHBondContact O-N 2.88Å; M450-F452 VanDerWaalsContact O-N 3.09Å; F452-S482 VanDerWaalsContact O-CB 3.23Å; F452-S482 WeakPolarHBondContact O-CB 3.11Å; F452-S482 PolarHBondContact O-OG 3.49Å; F452-A486 HydrophobicContact CB-CB 3.77Å; F452-A486 HydrophobicContact CD2-CB 4.35Å; F452-A486 HydrophobicContact CG-CB 4.12Å; F452-M490 HydrophobicContact CD2-CG 4.1Å; F452-M490 HydrophobicContact CE2-CG 3.46Å; F452-M490 VanDerWaalsContact CE2-CG 3.46Å; F452-M490 HydrophobicContact CE2-SD 3.5Å; F452-M490 WeakPolarHBondContact CE2-SD 3.43Å; F452-M490 HydrophobicContact CZ-CG 3.81Å; F452-M490 HydrophobicContact CZ-SD 3.58Å; F452-M490 VanDerWaalsContact CZ-SD 3.58Å
453	G	83.4	Confident	85.8	Confident	19 Å²	19	56 Å²	56	20%	0.196	30%	0.296	C	S	.	.	S	Bend	trans	155.4	178.7	176.4	0	0	0	0	0	114.4	M450 V455 Y477	M450-G453 PolarHBondContact O-N 3.39Å; M450-G453 VanDerWaalsContact O-N 3.09Å; G453-V455 PolarHBondContact O-N 2.91Å; G453-Y477 WeakPolarHBondContact O-CE1 3.34Å
454	N	86.8	Confident	85.3	Confident	100 Å²	100	59.4 Å²	59.4	54%	0.535	31%	0.309	S	S	.	.			trans	-75.8	112	-177.9	177.7	35	0	0	0	111.6	V456 Y477 D478	N454-V456 PolarHBondContact O-N 3.3Å; N454-Y477 WeakPolarHBondContact O-CA 3.33Å; N454-Y477 WeakPolarHBondContact O-CD1 3.32Å; N454-D478 WeakPolarHBondContact CB-OD2 3.43Å; N454-D478 PolarHBondContact ND2-OD2 3.49Å; N454-D478 PolarHBondContact O-N 3.18Å
455	V	88.7	Confident	84.7	Confident	18 Å²	18	64.5 Å²	64.5	11%	0.109	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	111.1	-177.8	176.5	0	0	0	0	110.4	L446 F449 G453 A458 V475 S476 Y477	L446-V455 HydrophobicContact CD1-CG1 4.1Å; L446-V455 HydrophobicContact CG-CB 4.4Å; L446-V455 HydrophobicContact CG-CG1 4.2Å; F449-V455 HydrophobicContact CB-CG2 4.16Å; G453-V455 PolarHBondContact O-N 2.91Å; V455-A458 HydrophobicContact CG1-CB 4.2Å; V455-V475 HydrophobicContact CG1-CG1 3.99Å; V455-V475 HydrophobicContact CG2-CG1 4.03Å; V455-S476 CarbonylContact C-O 3.12Å; V455-Y477 HydrophobicContact CG2-CD1 4.19Å; V455-Y477 HydrophobicContact CG2-CE1 3.7Å
456	V	87.2	Confident	84.2	Confident	58 Å²	58	68.3 Å²	68.3	35%	0.352	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	-34.5	176.7	176.7	0	0	0	0	111.8	K423 N454 S476 D478	K423-V456 HydrophobicContact CB-CG1 4.04Å; K423-V456 WeakPolarHBondContact O-CG1 3.1Å; N454-V456 PolarHBondContact O-N 3.3Å; V456-S476 PolarHBondContact N-O 3.36Å; V456-D478 HydrophobicContact CG2-CB 3.74Å
457	S	81.9	Confident	83.5	Confident	29 Å²	29	72.2 Å²	72.2	20%	0.203	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	123.6	175.7	-177.1	0	0	0	0	111.1	K423 V475 S476	K423-S457 WeakPolarHBondContact O-CB 3.48Å; S457-V475 CarbonylContact O-C 3.55Å; S457-V475 WeakPolarHBondContact O-CA 3.41Å; S457-S476 PolarHBondContact N-O 2.96Å; S457-S476 PolarHBondContact O-N 3.2Å
458	A	88.4	Confident	82.8	Confident	18 Å²	18	69.9 Å²	69.9	15%	0.149	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	146.4	161.2	0	0	0	0	0	109.5	L445 L446 V455 F474 V475	L445-A458 HydrophobicContact CD2-CB 4.37Å; L445-A458 HydrophobicContact CG-CB 4.31Å; L446-A458 HydrophobicContact CB-CB 3.8Å; L446-A458 HydrophobicContact CD1-CB 4.29Å; L446-A458 HydrophobicContact CG-CB 4.44Å; V455-A458 HydrophobicContact CG1-CB 4.2Å; A458-F474 CarbonylContact C-O 3.52Å; A458-F474 WeakPolarHBondContact CA-O 3.45Å; A458-V475 HydrophobicContact CB-CG2 4.35Å
459	K	87.3	Confident	82.5	Confident	78 Å²	78	68.5 Å²	68.5	34%	0.339	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	119.8	170.1	-172.8	167.3	-176.1	171.9	0	113.5	D442 F461 G473 F474	D442-K459 VanDerWaalsContact OD1-CA 3.23Å; D442-K459 WeakPolarHBondContact OD1-CA 3.43Å; K459-F461 HydrophobicContact CD-CE2 3.95Å; K459-F461 HydrophobicContact CD-CZ 4.45Å; K459-F461 HydrophobicContact CG-CD2 4.27Å; K459-F461 HydrophobicContact CG-CE2 3.94Å; K459-G473 CarbonylContact O-C 3.55Å; K459-G473 WeakPolarHBondContact O-CA 3.37Å; K459-F474 PolarHBondContact N-O 2.97Å; K459-F474 PolarHBondContact O-N 3.34Å
460	V	88.8	Confident	82.1	Confident	4 Å²	4	72.9 Å²	72.9	2%	0.024	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	149.3	167.7	180	0	0	0	0	109.9	L436 G441 D442 L445 I462 S469	L436-V460 HydrophobicContact CD1-CG1 4.47Å; L436-V460 HydrophobicContact CD1-CG2 3.94Å; G441-V460 VanDerWaalsContact C-CG2 3.5Å; G441-V460 WeakPolarHBondContact O-CG2 3.45Å; D442-V460 PolarHBondContact OD1-N 2.94Å; L445-V460 HydrophobicContact CB-CG2 3.99Å; L445-V460 HydrophobicContact CD2-CG2 3.72Å; L445-V460 HydrophobicContact CG-CG2 4.46Å; V460-I462 HydrophobicContact CG1-CG1 4.34Å; V460-S469 VanDerWaalsContact CG1-OG 3.3Å; V460-S469 WeakPolarHBondContact CG1-OG 3.27Å
461	F	84.6	Confident	82	Confident	66 Å²	66	69.7 Å²	69.7	29%	0.289	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	108.4	175.7	-84.4	-115.6	0	0	0	110.1	K459 K470 F472 F474	K459-F461 HydrophobicContact CD-CE2 3.95Å; K459-F461 HydrophobicContact CD-CZ 4.45Å; K459-F461 HydrophobicContact CG-CD2 4.27Å; K459-F461 HydrophobicContact CG-CE2 3.94Å; F461-K470 HydrophobicContact CB-CD 4.5Å; F461-K470 WeakPolarHBondContact O-CB 3.47Å; F461-K470 WeakPolarHBondContact O-CG 3.43Å; F461-K470 PolarHBondContact O-N 3.08Å; F461-F472 HydrophobicContact CB-CD2 3.85Å; F461-F472 HydrophobicContact CB-CE2 3.36Å; F461-F472 HydrophobicContact CB-CZ 3.76Å; F461-F472 AromaticContact CD1-CE2 3.99Å; F461-F472 HydrophobicContact CD1-CE2 3.99Å; F461-F472 HydrophobicContact CD1-CZ 4.36Å; F461-F472 HydrophobicContact CD2-CE2 4.16Å; F461-F472 HydrophobicContact CG-CD2 4.25Å; F461-F472 AromaticContact CG-CE2 3.56Å; F461-F472 HydrophobicContact CG-CE2 3.56Å; F461-F472 HydrophobicContact CG-CZ 4.21Å; F461-F472 PolarHBondContact N-O 3.42Å; F461-F474 AromaticContact CD2-CD2 3.84Å; F461-F474 HydrophobicContact CD2-CD2 3.84Å; F461-F474 AromaticContact CD2-CE2 3.77Å; F461-F474 HydrophobicContact CD2-CE2 3.77Å; F461-F474 AromaticContact CE2-CD2 3.45Å; F461-F474 HydrophobicContact CE2-CD2 3.45Å; F461-F474 VanDerWaalsContact CE2-CD2 3.45Å; F461-F474 AromaticContact CE2-CE2 3.4Å; F461-F474 HydrophobicContact CE2-CE2 3.4Å; F461-F474 VanDerWaalsContact CE2-CE2 3.4Å; F461-F474 HydrophobicContact CZ-CD2 4.29Å; F461-F474 AromaticContact CZ-CE2 3.87Å; F461-F474 HydrophobicContact CZ-CE2 3.87Å
462	I	83.4	Confident	82	Confident	79 Å²	79	67.5 Å²	67.5	41%	0.405	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	147.2	178.8	-64.5	167.9	0	0	0	109.5	V460 N467	V460-I462 HydrophobicContact CG1-CG1 4.34Å; I462-N467 VanDerWaalsContact CG2-C 3.45Å; I462-N467 WeakPolarHBondContact CG2-O 3.17Å
463	D	81.3	Confident	82.3	Confident	43 Å²	43	64.9 Å²	64.9	23%	0.23	34%	0.335	C	S	.	.			trans	-80.5	120.6	170.9	-159.1	-49.8	0	0	0	111	Q465 T466 N467 L468 K470	D463-Q465 PolarHBondContact O-N 2.89Å; D463-Q465 PolarHBondContact OD1-N 2.84Å; D463-T466 PolarHBondContact O-N 3.29Å; D463-N467 VanDerWaalsContact O-CA 3.27Å; D463-N467 WeakPolarHBondContact O-CA 3.43Å; D463-N467 PolarHBondContact O-N 3.05Å; D463-L468 PolarHBondContact N-O 2.9Å; D463-K470 HydrophobicContact CB-CG 4.16Å; D463-K470 IonicContact OD2-NZ 2.58Å; D463-K470 PolarHBondContact OD2-NZ 3.38Å
464	K	74	Confident	82.6	Confident	193 Å²	193	65.8 Å²	65.8	84%	0.839	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-19	-176.9	-168.9	175.9	177.7	-173.2	0	113.4
465	Q	74.4	Confident	82.8	Confident	180 Å²	180	61.1 Å²	61.1	84%	0.841	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-28.9	178.4	-69.7	-175.6	98.8	0	0	113.4	D463	D463-Q465 PolarHBondContact O-N 2.89Å; D463-Q465 PolarHBondContact OD1-N 2.84Å
466	T	75.6	Confident	82.8	Confident	81 Å²	81	60.4 Å²	60.4	50%	0.497	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-12.8	-176.4	59.8	0	0	0	0	113.7	D463 L468	D463-T466 PolarHBondContact O-N 3.29Å; T466-L468 PolarHBondContact O-N 3Å; T466-L468 PolarHBondContact OG1-N 3.26Å
467	N	73	Confident	82.9	Confident	128 Å²	128	57.7 Å²	57.7	68%	0.684	29%	0.288	S	S	*	.			trans	58.1	17.6	-167.7	-65.4	-77.7	0	0	0	114.6	I462 D463	I462-N467 VanDerWaalsContact CG2-C 3.45Å; I462-N467 WeakPolarHBondContact CG2-O 3.17Å; D463-N467 VanDerWaalsContact O-CA 3.27Å; D463-N467 WeakPolarHBondContact O-CA 3.43Å; D463-N467 PolarHBondContact O-N 3.05Å
468	L	71.4	Confident	83.1	Confident	82 Å²	82	59.7 Å²	59.7	43%	0.429	30%	0.297	S	S	.	.			trans	-95.1	138.8	178.6	-57.4	167.3	0	0	0	110	Q438 D463 T466 K470	Q438-L468 HydrophobicContact CG-CB 4.19Å; Q438-L468 HydrophobicContact CG-CD2 4.38Å; D463-L468 PolarHBondContact N-O 2.9Å; T466-L468 PolarHBondContact O-N 3Å; T466-L468 PolarHBondContact OG1-N 3.26Å; L468-K470 PolarHBondContact O-N 3.35Å
469	S	78.2	Confident	83	Confident	10 Å²	10	62.1 Å²	62.1	7%	0.07	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	135	176.7	179.1	0	0	0	0	111.1	Q438 V460 C471	Q438-S469 VanDerWaalsContact O-CB 3.26Å; Q438-S469 WeakPolarHBondContact O-CB 3.26Å; V460-S469 VanDerWaalsContact CG1-OG 3.3Å; V460-S469 WeakPolarHBondContact CG1-OG 3.27Å; S469-C471 PolarHBondContact O-N 3.4Å; S469-C471 PolarHBondContact OG-N 2.97Å
470	K	78.3	Confident	82.9	Confident	91 Å²	91	60.7 Å²	60.7	40%	0.396	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	12	172.6	-61.2	176.2	176.1	-74	0	112.4	F461 D463 L468 F472	F461-K470 HydrophobicContact CB-CD 4.5Å; F461-K470 WeakPolarHBondContact O-CB 3.47Å; F461-K470 WeakPolarHBondContact O-CG 3.43Å; F461-K470 PolarHBondContact O-N 3.08Å; D463-K470 HydrophobicContact CB-CG 4.16Å; D463-K470 IonicContact OD2-NZ 2.58Å; D463-K470 PolarHBondContact OD2-NZ 3.38Å; L468-K470 PolarHBondContact O-N 3.35Å; K470-F472 HydrophobicContact CB-CD1 3.71Å; K470-F472 HydrophobicContact CB-CE1 3.52Å; K470-F472 HydrophobicContact CB-CZ 4.31Å; K470-F472 HydrophobicContact CD-CE1 3.88Å; K470-F472 HydrophobicContact CD-CZ 4.05Å; K470-F472 HydrophobicContact CG-CE1 4.35Å; K470-F472 WeakPolarHBondContact O-CD1 3.24Å; K470-F472 PolarHBondContact O-N 3.26Å
471	C	83.2	Confident	82.9	Confident	31 Å²	31	65 Å²	65	21%	0.209	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	60	24.3	-177.7	-50.1	0	0	0	0	113.9	Y434 H435 L436 S469	Y434-C471 CarbonylContact C-O 3.54Å; H435-C471 WeakPolarHBondContact CA-O 3.43Å; H435-C471 PolarHBondContact N-O 3.49Å; L436-C471 PolarHBondContact N-O 3.44Å; L436-C471 WeakPolarHBondContact O-CA 3.44Å; L436-C471 VanDerWaalsContact O-CB 3.26Å; L436-C471 WeakPolarHBondContact O-CB 3.45Å; S469-C471 PolarHBondContact O-N 3.4Å; S469-C471 PolarHBondContact OG-N 2.97Å
472	F	88.3	Confident	83.1	Confident	55 Å²	55	63 Å²	63	24%	0.241	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	154.5	175.3	72.3	-103.6	0	0	0	113.2	F432 I433 F461 K470 F474	F432-F472 HydrophobicContact CE2-CB 4.38Å; F432-F472 AromaticContact CE2-CD2 3.63Å; F432-F472 HydrophobicContact CE2-CD2 3.63Å; F432-F472 HydrophobicContact CE2-CE2 4.28Å; F432-F472 HydrophobicContact CE2-CG 4.33Å; F432-F472 HydrophobicContact CZ-CB 4.44Å; F432-F472 AromaticContact CZ-CD2 3.82Å; F432-F472 HydrophobicContact CZ-CD2 3.82Å; F432-F472 HydrophobicContact CZ-CE2 4.32Å; F432-F472 HydrophobicContact CZ-CG 4.27Å; I433-F472 CarbonylContact O-C 3.52Å; I433-F472 WeakPolarHBondContact O-CA 3.44Å; I433-F472 WeakPolarHBondContact O-CB 3.37Å; F461-F472 HydrophobicContact CB-CD2 3.85Å; F461-F472 HydrophobicContact CB-CE2 3.36Å; F461-F472 HydrophobicContact CB-CZ 3.76Å; F461-F472 AromaticContact CD1-CE2 3.99Å; F461-F472 HydrophobicContact CD1-CE2 3.99Å; F461-F472 HydrophobicContact CD1-CZ 4.36Å; F461-F472 HydrophobicContact CD2-CE2 4.16Å; F461-F472 HydrophobicContact CG-CD2 4.25Å; F461-F472 AromaticContact CG-CE2 3.56Å; F461-F472 HydrophobicContact CG-CE2 3.56Å; F461-F472 HydrophobicContact CG-CZ 4.21Å; F461-F472 PolarHBondContact N-O 3.42Å; K470-F472 HydrophobicContact CB-CD1 3.71Å; K470-F472 HydrophobicContact CB-CE1 3.52Å; K470-F472 HydrophobicContact CB-CZ 4.31Å; K470-F472 HydrophobicContact CD-CE1 3.88Å; K470-F472 HydrophobicContact CD-CZ 4.05Å; K470-F472 HydrophobicContact CG-CE1 4.35Å; K470-F472 WeakPolarHBondContact O-CD1 3.24Å; K470-F472 PolarHBondContact O-N 3.26Å; F472-F474 HydrophobicContact CE2-CE2 4.41Å
473	G	89.4	Confident	83.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	171.8	-179.5	0	0	0	0	0	112.9	F432 I433 K459	F432-G473 WeakPolarHBondContact CD2-O 3.29Å; I433-G473 PolarHBondContact N-O 3.45Å; I433-G473 PolarHBondContact O-N 3Å; K459-G473 CarbonylContact O-C 3.55Å; K459-G473 WeakPolarHBondContact O-CA 3.37Å
474	F	91	Very high	83.6	Confident	38 Å²	38	62.5 Å²	62.5	17%	0.167	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.4	179.3	-58	-98.2	0	0	0	109.4	L431 F432 A458 K459 F461 F472 K505	L431-F474 WeakPolarHBondContact O-CA 3.01Å; F432-F474 HydrophobicContact CB-CD1 4.37Å; F432-F474 HydrophobicContact CB-CE1 4.5Å; F432-F474 AromaticContact CD2-CD1 3.39Å; F432-F474 HydrophobicContact CD2-CD1 3.39Å; F432-F474 HydrophobicContact CD2-CD2 4.12Å; F432-F474 AromaticContact CD2-CE1 3.24Å; F432-F474 HydrophobicContact CD2-CE1 3.24Å; F432-F474 AromaticContact CD2-CE2 4Å; F432-F474 HydrophobicContact CD2-CE2 4Å; F432-F474 AromaticContact CD2-CG 3.86Å; F432-F474 HydrophobicContact CD2-CG 3.86Å; F432-F474 AromaticContact CD2-CZ 3.58Å; F432-F474 HydrophobicContact CD2-CZ 3.58Å; F432-F474 AromaticContact CE2-CD1 3.97Å; F432-F474 HydrophobicContact CE2-CD1 3.97Å; F432-F474 HydrophobicContact CE2-CD2 4.05Å; F432-F474 AromaticContact CE2-CE1 3.47Å; F432-F474 HydrophobicContact CE2-CE1 3.47Å; F432-F474 VanDerWaalsContact CE2-CE1 3.47Å; F432-F474 AromaticContact CE2-CE2 3.55Å; F432-F474 HydrophobicContact CE2-CE2 3.55Å; F432-F474 HydrophobicContact CE2-CG 4.26Å; F432-F474 AromaticContact CE2-CZ 3.24Å; F432-F474 HydrophobicContact CE2-CZ 3.24Å; F432-F474 HydrophobicContact CG-CD1 4.16Å; F432-F474 AromaticContact CG-CE1 3.94Å; F432-F474 HydrophobicContact CG-CE1 3.94Å; F432-F474 HydrophobicContact CZ-CE1 4.29Å; F432-F474 AromaticContact CZ-CZ 3.97Å; F432-F474 HydrophobicContact CZ-CZ 3.97Å; A458-F474 CarbonylContact C-O 3.52Å; A458-F474 WeakPolarHBondContact CA-O 3.45Å; K459-F474 PolarHBondContact N-O 2.97Å; K459-F474 PolarHBondContact O-N 3.34Å; F461-F474 AromaticContact CD2-CD2 3.84Å; F461-F474 HydrophobicContact CD2-CD2 3.84Å; F461-F474 AromaticContact CD2-CE2 3.77Å; F461-F474 HydrophobicContact CD2-CE2 3.77Å; F461-F474 AromaticContact CE2-CD2 3.45Å; F461-F474 HydrophobicContact CE2-CD2 3.45Å; F461-F474 VanDerWaalsContact CE2-CD2 3.45Å; F461-F474 AromaticContact CE2-CE2 3.4Å; F461-F474 HydrophobicContact CE2-CE2 3.4Å; F461-F474 VanDerWaalsContact CE2-CE2 3.4Å; F461-F474 HydrophobicContact CZ-CD2 4.29Å; F461-F474 AromaticContact CZ-CE2 3.87Å; F461-F474 HydrophobicContact CZ-CE2 3.87Å; F472-F474 HydrophobicContact CE2-CE2 4.41Å; F474-K505 HydrophobicContact CD1-CD 3.96Å; F474-K505 HydrophobicContact CD1-CG 4.45Å; F474-K505 HydrophobicContact CE1-CD 4.19Å; F474-K505 HydrophobicContact CE1-CG 4.46Å
475	V	90.5	Very high	84.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.9	170.2	172.4	0	0	0	0	107.7	L431 I433 L445 F449 V455 S457 A458 Y477	L431-V475 WeakPolarHBondContact CA-O 3.36Å; L431-V475 HydrophobicContact CB-CB 4.45Å; L431-V475 WeakPolarHBondContact CB-O 3.49Å; L431-V475 PolarHBondContact N-O 3.07Å; L431-V475 PolarHBondContact O-N 3.33Å; I433-V475 HydrophobicContact CD1-CB 3.91Å; I433-V475 HydrophobicContact CD1-CG2 3.68Å; L445-V475 HydrophobicContact CD1-CG2 3.82Å; L445-V475 HydrophobicContact CD2-CG2 3.87Å; L445-V475 HydrophobicContact CG-CG2 3.61Å; F449-V475 HydrophobicContact CB-CG1 3.99Å; F449-V475 HydrophobicContact CB-CG2 4.24Å; F449-V475 HydrophobicContact CD1-CB 4.33Å; F449-V475 HydrophobicContact CD1-CG1 4.14Å; F449-V475 HydrophobicContact CD1-CG2 4.17Å; F449-V475 HydrophobicContact CD2-CG2 4.28Å; F449-V475 HydrophobicContact CG-CG1 4.24Å; F449-V475 HydrophobicContact CG-CG2 3.96Å; V455-V475 HydrophobicContact CG1-CG1 3.99Å; V455-V475 HydrophobicContact CG2-CG1 4.03Å; S457-V475 CarbonylContact O-C 3.55Å; S457-V475 WeakPolarHBondContact O-CA 3.41Å; A458-V475 HydrophobicContact CB-CG2 4.35Å; V475-Y477 HydrophobicContact CG1-CD2 4.17Å; V475-Y477 HydrophobicContact CG1-CE2 3.75Å
476	S	88.2	Confident	84.9	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.7	178.4	-160.3	0	0	0	0	108.9	G425 N430 V455 V456 S457	G425-S476 PolarHBondContact N-OG 3.31Å; N430-S476 WeakPolarHBondContact OD1-CB 3.28Å; N430-S476 PolarHBondContact OD1-OG 2.84Å; V455-S476 CarbonylContact C-O 3.12Å; V456-S476 PolarHBondContact N-O 3.36Å; S457-S476 PolarHBondContact N-O 2.96Å; S457-S476 PolarHBondContact O-N 3.2Å
477	Y	89.1	Confident	85.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	163.2	173.6	-71.9	-83.2	0	0	0	111	A429 L431 F449 G453 N454 V455 V475 N479 A483 A486	A429-Y477 VanDerWaalsContact CB-O 3.27Å; A429-Y477 WeakPolarHBondContact CB-O 3.47Å; A429-Y477 PolarHBondContact O-N 3.34Å; L431-Y477 HydrophobicContact CD1-CD2 4.27Å; L431-Y477 HydrophobicContact CD1-CE2 3.71Å; L431-Y477 HydrophobicContact CG-CD2 4.43Å; L431-Y477 HydrophobicContact CG-CE2 4.34Å; F449-Y477 WeakPolarHBondContact CB-OH 3.48Å; F449-Y477 HydrophobicContact CD1-CE2 4.41Å; F449-Y477 WeakPolarHBondContact CD1-OH 3.43Å; F449-Y477 PolarHBondContact O-OH 2.99Å; G453-Y477 WeakPolarHBondContact O-CE1 3.34Å; N454-Y477 WeakPolarHBondContact O-CA 3.33Å; N454-Y477 WeakPolarHBondContact O-CD1 3.32Å; V455-Y477 HydrophobicContact CG2-CD1 4.19Å; V455-Y477 HydrophobicContact CG2-CE1 3.7Å; V475-Y477 HydrophobicContact CG1-CD2 4.17Å; V475-Y477 HydrophobicContact CG1-CE2 3.75Å; Y477-N479 VanDerWaalsContact C-N 3.34Å; Y477-A483 HydrophobicContact CD2-CB 3.8Å; Y477-A483 HydrophobicContact CG-CB 4.46Å; Y477-A486 HydrophobicContact CE2-CB 3.78Å; Y477-A486 WeakPolarHBondContact OH-CB 3.17Å
478	D	87.4	Confident	86.3	Confident	72 Å²	72	46 Å²	46	39%	0.385	24%	0.244	S	C	.	.	S	Bend	trans	-75.5	-24.3	167.6	60.7	-4.7	0	0	0	112.8	P426 N454 V456	P426-D478 WeakPolarHBondContact CD-O 3.39Å; P426-D478 WeakPolarHBondContact CG-O 3.33Å; N454-D478 WeakPolarHBondContact CB-OD2 3.43Å; N454-D478 PolarHBondContact ND2-OD2 3.49Å; N454-D478 PolarHBondContact O-N 3.18Å; V456-D478 HydrophobicContact CG2-CB 3.74Å
479	N	85	Confident	87	Confident	69 Å²	69	45.4 Å²	45.4	37%	0.369	25%	0.247	S	C	.	.			trans	-127.2	128.1	-172.8	-172.8	-17.2	0	0	0	112	Y477 V481 S482 A483	Y477-N479 VanDerWaalsContact C-N 3.34Å; N479-V481 PolarHBondContact O-N 2.99Å; N479-V481 WeakPolarHBondContact OD1-CB 3.4Å; N479-V481 WeakPolarHBondContact OD1-CG2 3.38Å; N479-V481 PolarHBondContact OD1-N 3.08Å; N479-S482 PolarHBondContact O-N 3.29Å; N479-A483 PolarHBondContact O-N 3.41Å
480	P	85.3	Confident	87.3	Confident	48 Å²	48	45.3 Å²	45.3	31%	0.312	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-25.8	175.3	25.5	-35.5	0	0	0	113.9	G428 A429 A483 Q484	G428-P480 WeakPolarHBondContact O-CB 3.05Å; A429-P480 HydrophobicContact CB-CB 4.49Å; P480-A483 PolarHBondContact O-N 2.87Å; P480-Q484 WeakPolarHBondContact O-CG 3.43Å; P480-Q484 PolarHBondContact O-N 3.48Å
481	V	88.6	Confident	87.8	Confident	94 Å²	94	44.9 Å²	44.9	57%	0.57	25%	0.247	S	C	*	.	H	α-helix	trans	-66.2	-43.6	176.6	-177.9	0	0	0	0	111	N479 A483 Q484 A485	N479-V481 PolarHBondContact O-N 2.99Å; N479-V481 WeakPolarHBondContact OD1-CB 3.4Å; N479-V481 WeakPolarHBondContact OD1-CG2 3.38Å; N479-V481 PolarHBondContact OD1-N 3.08Å; V481-A483 VanDerWaalsContact C-N 3.34Å; V481-A483 PolarHBondContact O-N 3.42Å; V481-Q484 PolarHBondContact O-N 3.15Å; V481-A485 PolarHBondContact O-N 3.48Å
482	S	89	Confident	87.8	Confident	23 Å²	23	44.8 Å²	44.8	16%	0.161	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-39.9	173.8	-71.3	0	0	0	0	112.3	F452 N479 Q484 A485 A486	F452-S482 VanDerWaalsContact O-CB 3.23Å; F452-S482 WeakPolarHBondContact O-CB 3.11Å; F452-S482 PolarHBondContact O-OG 3.49Å; N479-S482 PolarHBondContact O-N 3.29Å; S482-Q484 VanDerWaalsContact C-N 3.33Å; S482-Q484 PolarHBondContact O-N 3.44Å; S482-A485 PolarHBondContact O-N 2.75Å; S482-A486 WeakPolarHBondContact O-CB 3.37Å; S482-A486 PolarHBondContact O-N 3.45Å
483	A	88.1	Confident	87.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-39.2	174.8	0	0	0	0	0	112.2	L431 Y477 N479 P480 V481 I487	L431-A483 HydrophobicContact CD2-CB 3.89Å; L431-A483 HydrophobicContact CG-CB 4.16Å; Y477-A483 HydrophobicContact CD2-CB 3.8Å; Y477-A483 HydrophobicContact CG-CB 4.46Å; N479-A483 PolarHBondContact O-N 3.41Å; P480-A483 PolarHBondContact O-N 2.87Å; V481-A483 VanDerWaalsContact C-N 3.34Å; V481-A483 PolarHBondContact O-N 3.42Å; A483-I487 VanDerWaalsContact O-CG1 3.31Å; A483-I487 WeakPolarHBondContact O-CG1 3.29Å; A483-I487 PolarHBondContact O-N 3.23Å
484	Q	87.9	Confident	87.2	Confident	113 Å²	113	52 Å²	52	53%	0.528	28%	0.284	S	S	.	.	H	α-helix	trans	-68.1	-42.7	174.6	-72.1	-179.3	5.5	0	0	112.7	P480 V481 S482 A486 I487 Q488	P480-Q484 WeakPolarHBondContact O-CG 3.43Å; P480-Q484 PolarHBondContact O-N 3.48Å; V481-Q484 PolarHBondContact O-N 3.15Å; S482-Q484 VanDerWaalsContact C-N 3.33Å; S482-Q484 PolarHBondContact O-N 3.44Å; Q484-A486 PolarHBondContact O-N 3.41Å; Q484-I487 PolarHBondContact O-N 3.36Å; Q484-Q488 WeakPolarHBondContact O-CG 3.45Å; Q484-Q488 PolarHBondContact O-N 3.23Å
485	A	87.9	Confident	86.6	Confident	39 Å²	39	51.6 Å²	51.6	32%	0.322	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-45.4	175	0	0	0	0	0	111.5	V481 S482 I487 Q488 S489	V481-A485 PolarHBondContact O-N 3.48Å; S482-A485 PolarHBondContact O-N 2.75Å; A485-I487 PolarHBondContact O-N 3.42Å; A485-Q488 PolarHBondContact O-N 3.22Å; A485-Q488 VanDerWaalsContact O-N 3.11Å; A485-S489 PolarHBondContact O-N 3.48Å; A485-S489 PolarHBondContact O-OG 3.32Å
486	A	88.5	Confident	85.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.8	-39.5	175	0	0	0	0	0	112.7	L431 F449 F452 Y477 S482 Q484 M490	L431-A486 HydrophobicContact CD1-CB 3.84Å; F449-A486 HydrophobicContact CD1-CB 4.19Å; F449-A486 HydrophobicContact CE1-CB 4.37Å; F452-A486 HydrophobicContact CB-CB 3.77Å; F452-A486 HydrophobicContact CD2-CB 4.35Å; F452-A486 HydrophobicContact CG-CB 4.12Å; Y477-A486 HydrophobicContact CE2-CB 3.78Å; Y477-A486 WeakPolarHBondContact OH-CB 3.17Å; S482-A486 WeakPolarHBondContact O-CB 3.37Å; S482-A486 PolarHBondContact O-N 3.45Å; Q484-A486 PolarHBondContact O-N 3.41Å; A486-M490 WeakPolarHBondContact O-CB 3.43Å; A486-M490 PolarHBondContact O-N 3.27Å
487	I	90	Very high	85.3	Confident	38 Å²	38	63.8 Å²	63.8	20%	0.195	36%	0.36	C	S	.	.	H	α-helix	trans	-59.5	-48.2	171.3	-69.8	160.7	0	0	0	110.4	L431 A483 Q484 A485 S489 N491 V502 L504	L431-I487 HydrophobicContact CD1-CG1 4.33Å; L431-I487 HydrophobicContact CD2-CD1 3.52Å; L431-I487 HydrophobicContact CD2-CG1 3.59Å; A483-I487 VanDerWaalsContact O-CG1 3.31Å; A483-I487 WeakPolarHBondContact O-CG1 3.29Å; A483-I487 PolarHBondContact O-N 3.23Å; Q484-I487 PolarHBondContact O-N 3.36Å; A485-I487 PolarHBondContact O-N 3.42Å; I487-S489 PolarHBondContact O-N 3.32Å; I487-N491 HydrophobicContact CG2-CB 4.38Å; I487-N491 WeakPolarHBondContact O-CB 3.47Å; I487-N491 PolarHBondContact O-N 2.91Å; I487-V502 HydrophobicContact CG1-CG1 3.95Å; I487-L504 HydrophobicContact CD1-CB 4.13Å
488	Q	87.5	Confident	84.7	Confident	159 Å²	159	69.4 Å²	69.4	74%	0.743	39%	0.385	S	S	*	.	H	α-helix	trans	-63.9	-38.6	-175.8	-70.1	175.9	19.2	0	0	112.9	Q484 A485	Q484-Q488 WeakPolarHBondContact O-CG 3.45Å; Q484-Q488 PolarHBondContact O-N 3.23Å; A485-Q488 PolarHBondContact O-N 3.22Å; A485-Q488 VanDerWaalsContact O-N 3.11Å
489	S	85.6	Confident	84.6	Confident	68 Å²	68	73 Å²	73	48%	0.476	39%	0.393	S	S	.	.	H	α-helix	trans	-86.7	-33.5	-179.1	-58.3	0	0	0	0	114.5	A485 I487	A485-S489 PolarHBondContact O-N 3.48Å; A485-S489 PolarHBondContact O-OG 3.32Å; I487-S489 PolarHBondContact O-N 3.32Å
490	M	85.2	Confident	84.8	Confident	9 Å²	9	69.8 Å²	69.8	4%	0.044	38%	0.376	C	S	.	.	H	α-helix	trans	-102.2	-16.7	-172.1	-60.8	-59.5	-61.3	0	0	114.4	M448 F449 F452 A486 G492 F493 L500 V502	M448-M490 HydrophobicContact CE-CE 4.37Å; M448-M490 HydrophobicContact CG-CE 3.52Å; M448-M490 HydrophobicContact SD-CE 3.51Å; M448-M490 VanDerWaalsContact SD-CE 3.51Å; F449-M490 HydrophobicContact CE1-CB 4.23Å; F449-M490 HydrophobicContact CE1-CG 4.24Å; F449-M490 HydrophobicContact CE2-CE 4.43Å; F449-M490 HydrophobicContact CZ-CB 4Å; F449-M490 HydrophobicContact CZ-CG 4.15Å; F452-M490 HydrophobicContact CD2-CG 4.1Å; F452-M490 HydrophobicContact CE2-CG 3.46Å; F452-M490 VanDerWaalsContact CE2-CG 3.46Å; F452-M490 HydrophobicContact CE2-SD 3.5Å; F452-M490 WeakPolarHBondContact CE2-SD 3.43Å; F452-M490 HydrophobicContact CZ-CG 3.81Å; F452-M490 HydrophobicContact CZ-SD 3.58Å; F452-M490 VanDerWaalsContact CZ-SD 3.58Å; A486-M490 WeakPolarHBondContact O-CB 3.43Å; A486-M490 PolarHBondContact O-N 3.27Å; M490-G492 PolarHBondContact O-N 3.36Å; M490-F493 HydrophobicContact CE-CB 4.23Å; M490-F493 HydrophobicContact CE-CD1 3.98Å; M490-F493 HydrophobicContact CE-CD2 4.45Å; M490-F493 HydrophobicContact CE-CE1 4.49Å; M490-F493 HydrophobicContact CE-CG 3.96Å; M490-F493 VanDerWaalsContact O-CB 3.28Å; M490-F493 WeakPolarHBondContact O-CB 3.46Å; M490-F493 PolarHBondContact O-N 3.24Å; M490-F493 HydrophobicContact SD-CD2 4.45Å; M490-F493 HydrophobicContact SD-CG 4.44Å; M490-L500 HydrophobicContact CE-CD1 3.9Å; M490-V502 HydrophobicContact CB-CG2 3.81Å
491	N	87.5	Confident	84.8	Confident	81 Å²	81	71.7 Å²	71.7	43%	0.433	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	118	175.2	-173.3	41.5	0	0	0	110.9	I487 K501 V502	I487-N491 HydrophobicContact CG2-CB 4.38Å; I487-N491 WeakPolarHBondContact O-CB 3.47Å; I487-N491 PolarHBondContact O-N 2.91Å; N491-K501 WeakPolarHBondContact OD1-CA 3.49Å; N491-V502 HydrophobicContact CB-CB 4.06Å; N491-V502 PolarHBondContact OD1-N 3.44Å; N491-V502 PolarHBondContact OD1-O 3.24Å
492	G	83.4	Confident	84.9	Confident	29 Å²	29	67.3 Å²	67.3	30%	0.299	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	-4.4	-174	0	0	0	0	0	114.6	M490 Q494 R499 L500	M490-G492 PolarHBondContact O-N 3.36Å; G492-Q494 PolarHBondContact O-N 3.05Å; G492-R499 PolarHBondContact O-NH1 3.33Å; G492-R499 VanDerWaalsContact O-NH1 3.07Å; G492-L500 WeakPolarHBondContact CA-O 3.41Å; G492-L500 PolarHBondContact N-O 2.91Å
493	F	84.1	Confident	84.8	Confident	94 Å²	94	70 Å²	70	41%	0.412	36%	0.363	S	S	.	.			trans	-58	128.4	176	-175.6	-91.6	0	0	0	110.5	M490 I495 R499 L500	M490-F493 HydrophobicContact CE-CB 4.23Å; M490-F493 HydrophobicContact CE-CD1 3.98Å; M490-F493 HydrophobicContact CE-CD2 4.45Å; M490-F493 HydrophobicContact CE-CE1 4.49Å; M490-F493 HydrophobicContact CE-CG 3.96Å; M490-F493 VanDerWaalsContact O-CB 3.28Å; M490-F493 WeakPolarHBondContact O-CB 3.46Å; M490-F493 PolarHBondContact O-N 3.24Å; M490-F493 HydrophobicContact SD-CD2 4.45Å; M490-F493 HydrophobicContact SD-CG 4.44Å; F493-I495 HydrophobicContact CD1-CB 4.41Å; F493-I495 HydrophobicContact CE1-CB 4.32Å; F493-R499 CarbonylContact O-C 3.59Å; F493-R499 WeakPolarHBondContact O-CA 3.21Å; F493-L500 HydrophobicContact CB-CD1 4.47Å; F493-L500 HydrophobicContact CD1-CD1 4.09Å; F493-L500 PolarHBondContact O-N 3.48Å
494	Q	81.6	Confident	84.7	Confident	112 Å²	112	73.9 Å²	73.9	52%	0.523	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.8	-175.4	-174.1	168.3	-22.4	0	0	110.5	G492 R499	G492-Q494 PolarHBondContact O-N 3.05Å; Q494-R499 HydrophobicContact CB-CG 4.12Å; Q494-R499 HydrophobicContact CG-CG 4.33Å; Q494-R499 VanDerWaalsContact OE1-NH2 3.08Å
495	I	78.1	Confident	84.4	Confident	31 Å²	31	71.2 Å²	71.2	16%	0.159	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.4	177.7	-170.7	162.6	0	0	0	110.5	P437 F440 M448 F493 M497 K498 L500	P437-I495 HydrophobicContact CG-CB 4.48Å; P437-I495 HydrophobicContact CG-CD1 3.88Å; P437-I495 HydrophobicContact CG-CG1 3.84Å; P437-I495 HydrophobicContact CG-CG2 3.87Å; F440-I495 HydrophobicContact CE1-CD1 4.12Å; F440-I495 HydrophobicContact CE2-CD1 3.75Å; F440-I495 HydrophobicContact CZ-CD1 3.42Å; F440-I495 VanDerWaalsContact CZ-CD1 3.42Å; M448-I495 HydrophobicContact CE-CD1 3.65Å; F493-I495 HydrophobicContact CD1-CB 4.41Å; F493-I495 HydrophobicContact CE1-CB 4.32Å; I495-M497 PolarHBondContact O-N 3.36Å; I495-K498 PolarHBondContact N-O 3.46Å; I495-K498 PolarHBondContact O-N 3.27Å; I495-K498 VanDerWaalsContact O-N 3.16Å; I495-L500 HydrophobicContact CG2-CD1 4.28Å; I495-L500 HydrophobicContact CG2-CD2 3.66Å; I495-L500 HydrophobicContact CG2-CG 3.72Å
496	G	75.4	Confident	83.6	Confident	65 Å²	65	78.1 Å²	78.1	67%	0.67	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	-125.6	-166.8	0	0	0	0	0	111.3
497	M	75.9	Confident	82.1	Confident	196 Å²	196	79.3 Å²	79.3	97%	0.966	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	5.2	-176.8	-58	178.8	-176.4	0	0	114.4	I495	I495-M497 PolarHBondContact O-N 3.36Å
498	K	77.7	Confident	80.5	Confident	117 Å²	117	87.3 Å²	87.3	51%	0.509	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	161.1	-175.5	-70.8	-177.8	179.5	172	0	112.4	H435 I495	H435-K498 HydrophobicContact CB-CB 4.2Å; H435-K498 HydrophobicContact CB-CD 4.31Å; I495-K498 PolarHBondContact N-O 3.46Å; I495-K498 PolarHBondContact O-N 3.27Å; I495-K498 VanDerWaalsContact O-N 3.16Å
499	R	84.3	Confident	78.6	Confident	148 Å²	148	85.5 Å²	85.5	56%	0.558	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.7	170.1	-68.9	179.4	-177.3	-89.7	-1.1	109.7	H435 G492 F493 Q494	H435-R499 WeakPolarHBondContact CB-O 3.29Å; H435-R499 PolarHBondContact ND1-O 3.39Å; G492-R499 PolarHBondContact O-NH1 3.33Å; G492-R499 VanDerWaalsContact O-NH1 3.07Å; F493-R499 CarbonylContact O-C 3.59Å; F493-R499 WeakPolarHBondContact O-CA 3.21Å; Q494-R499 HydrophobicContact CB-CG 4.12Å; Q494-R499 HydrophobicContact CG-CG 4.33Å; Q494-R499 VanDerWaalsContact OE1-NH2 3.08Å
500	L	88.3	Confident	76.8	Confident	2 Å²	2	88 Å²	88	1%	0.01	43%	0.432	C	S	.	.			trans	-57.6	140.1	171.3	-63.7	-176.6	0	0	0	109.6	I433 L436 M448 M490 G492 F493 I495	I433-L500 HydrophobicContact CG2-CD2 4.38Å; L436-L500 HydrophobicContact CD2-CD2 3.86Å; M448-L500 HydrophobicContact SD-CD1 3.8Å; M490-L500 HydrophobicContact CE-CD1 3.9Å; G492-L500 WeakPolarHBondContact CA-O 3.41Å; G492-L500 PolarHBondContact N-O 2.91Å; F493-L500 HydrophobicContact CB-CD1 4.47Å; F493-L500 HydrophobicContact CD1-CD1 4.09Å; F493-L500 PolarHBondContact O-N 3.48Å; I495-L500 HydrophobicContact CG2-CD1 4.28Å; I495-L500 HydrophobicContact CG2-CD2 3.66Å; I495-L500 HydrophobicContact CG2-CG 3.72Å
501	K	86.8	Confident	74.9	Confident	88 Å²	88	90.5 Å²	90.5	38%	0.383	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	108.2	172.4	-175.5	-176	-179.4	-175.9	0	108.1	I433 Y434 N491 Q503	I433-K501 WeakPolarHBondContact CA-O 3.39Å; Y434-K501 HydrophobicContact CD2-CB 4.35Å; Y434-K501 HydrophobicContact CD2-CD 4.25Å; Y434-K501 HydrophobicContact CD2-CG 4.37Å; Y434-K501 PolarHBondContact N-O 2.84Å; Y434-K501 PolarHBondContact O-N 3.2Å; N491-K501 WeakPolarHBondContact OD1-CA 3.49Å; K501-Q503 HydrophobicContact CG-CG 4.26Å
502	V	90.1	Very high	72.5	Confident	1 Å²	1	91.1 Å²	91.1	1%	0.006	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.6	-176.9	-175.4	0	0	0	0	108	L431 I433 F449 I487 M490 N491	L431-V502 HydrophobicContact CB-CG1 4.48Å; L431-V502 HydrophobicContact CD1-CG1 3.8Å; I433-V502 HydrophobicContact CG1-CG1 4.34Å; I433-V502 HydrophobicContact CG1-CG2 4.16Å; I433-V502 HydrophobicContact CG2-CG2 4.14Å; F449-V502 HydrophobicContact CE1-CG1 4.18Å; F449-V502 HydrophobicContact CE1-CG2 4.33Å; F449-V502 HydrophobicContact CZ-CG2 3.93Å; I487-V502 HydrophobicContact CG1-CG1 3.95Å; M490-V502 HydrophobicContact CB-CG2 3.81Å; N491-V502 HydrophobicContact CB-CB 4.06Å; N491-V502 PolarHBondContact OD1-N 3.44Å; N491-V502 PolarHBondContact OD1-O 3.24Å
503	Q	86.5	Confident	71.1	Confident	81 Å²	81	95.2 Å²	95.2	38%	0.379	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	154.4	179.8	-57	-164.8	-71.5	0	0	110	L431 F432 K501 K505	L431-Q503 CarbonylContact C-O 3.5Å; L431-Q503 WeakPolarHBondContact CA-O 3.42Å; F432-Q503 PolarHBondContact N-O 3.44Å; F432-Q503 PolarHBondContact O-N 2.8Å; K501-Q503 HydrophobicContact CG-CG 4.26Å; Q503-K505 PolarHBondContact O-N 3.36Å
504	L	87.3	Confident	69.1	Low	81 Å²	81	105 Å²	105	42%	0.424	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	129.2	166.8	-170.5	72.5	0	0	0	109	G428 N430 L431 I487 R506	G428-L504 WeakPolarHBondContact O-CD1 3.29Å; N430-L504 VanDerWaalsContact O-CD1 3.3Å; N430-L504 WeakPolarHBondContact O-CD1 3.34Å; L431-L504 HydrophobicContact CD2-CD1 4.25Å; I487-L504 HydrophobicContact CD1-CB 4.13Å; L504-R506 PolarHBondContact O-N 3.45Å; L504-R506 VanDerWaalsContact O-N 3.08Å
505	K	81.1	Confident	68.4	Low	57 Å²	57	104.7 Å²	104.7	25%	0.248	51%	0.507	C	S	.	.			trans	-65.7	108.4	170.6	-175.3	-171.2	-175.7	-178.3	0	107	E424 N430 F432 F474 Q503 S507	E424-K505 IonicContact OE1-NZ 3.69Å; E424-K505 PolarHBondContact OE1-NZ 3.16Å; E424-K505 IonicContact OE2-NZ 3.37Å; N430-K505 HydrophobicContact CB-CB 3.91Å; N430-K505 HydrophobicContact CB-CD 4Å; N430-K505 VanDerWaalsContact O-CB 3.31Å; N430-K505 WeakPolarHBondContact O-CB 3.4Å; N430-K505 PolarHBondContact O-N 3.15Å; F432-K505 HydrophobicContact CB-CB 4.47Å; F474-K505 HydrophobicContact CD1-CD 3.96Å; F474-K505 HydrophobicContact CD1-CG 4.45Å; F474-K505 HydrophobicContact CE1-CD 4.19Å; F474-K505 HydrophobicContact CE1-CG 4.46Å; Q503-K505 PolarHBondContact O-N 3.36Å; K505-S507 PolarHBondContact O-N 3.24Å
506	R	70.6	Confident	67.9	Low	183 Å²	183	108.5 Å²	108.5	69%	0.691	53%	0.525	S	S	*	.			trans	-50.5	131.3	174.1	-71.6	-174.4	177.8	171.2	-2.5	109.2	L504 S511	L504-R506 PolarHBondContact O-N 3.45Å; L504-R506 VanDerWaalsContact O-N 3.08Å; R506-S511 WeakPolarHBondContact CB-OG 3.47Å
507	S	57	Low	67.5	Low	25 Å²	25	110.9 Å²	110.9	18%	0.175	52%	0.517	C	S	.	.			trans	-66.8	162.2	174.3	84.3	0	0	0	0	110.2	E427 K505 N509 D510 S511	E427-S507 WeakPolarHBondContact OE1-CB 3.37Å; E427-S507 PolarHBondContact OE1-OG 3.37Å; K505-S507 PolarHBondContact O-N 3.24Å; S507-N509 PolarHBondContact O-N 3.49Å; S507-N509 PolarHBondContact OG-N 3.48Å; S507-D510 PolarHBondContact O-N 3.44Å; S507-D510 PolarHBondContact OG-N 3.5Å; S507-S511 PolarHBondContact O-OG 3.39Å
508	K	56.3	Low	67	Low	206 Å²	206	105.9 Å²	105.9	90%	0.896	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.1	-178.3	-147.7	167.4	-175.2	174.8	0	112.8
509	N	48.2	Very low	66.4	Low	122 Å²	122	105.3 Å²	105.3	65%	0.652	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-44.3	175	-69.7	-13.4	0	0	0	112	S507 S511	S507-N509 PolarHBondContact O-N 3.49Å; S507-N509 PolarHBondContact OG-N 3.48Å; N509-S511 VanDerWaalsContact C-N 3.27Å; N509-S511 PolarHBondContact O-N 3.43Å
510	D	48.1	Very low	65.2	Low	119 Å²	119	102.4 Å²	102.4	64%	0.636	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-11.7	-170.4	-163.8	-112.8	0	0	0	114.8	S507 K512	S507-D510 PolarHBondContact O-N 3.44Å; S507-D510 PolarHBondContact OG-N 3.5Å; D510-K512 PolarHBondContact O-N 3.45Å
511	S	44.1	Very low	63.5	Low	63 Å²	63	109.6 Å²	109.6	44%	0.441	52%	0.519	S	S	.	.	S	Bend	trans	-76.6	28.4	179.2	-60.2	0	0	0	0	114.2	R506 S507 N509	R506-S511 WeakPolarHBondContact CB-OG 3.47Å; S507-S511 PolarHBondContact O-OG 3.39Å; N509-S511 VanDerWaalsContact C-N 3.27Å; N509-S511 PolarHBondContact O-N 3.43Å
512	K	37.5	Very low	61.7	Low	93 Å²	93	111.2 Å²	111.2	40%	0.404	53%	0.529	S	S	.	.			trans	-124.8	95.5	-178.4	-71.5	178.1	170.1	-139.3	0	109.4	D77 S79 D510	D77-K512 IonicContact OD1-NZ 3.31Å; D77-K512 PolarHBondContact OD1-NZ 3.4Å; D77-K512 IonicContact OD2-NZ 3.44Å; S79-K512 VanDerWaalsContact OG-CD 3.24Å; S79-K512 WeakPolarHBondContact OG-CD 3.26Å; S79-K512 WeakPolarHBondContact OG-CE 2.91Å; S79-K512 PolarHBondContact OG-NZ 3.08Å; D510-K512 PolarHBondContact O-N 3.45Å
513	P	54.3	Low	59.4	Low	116 Å²	116	120.4 Å²	120.4	75%	0.753	57%	0.573	S	S	*	*			trans	-59.7	150.9	161.8	28.9	-33.9	0	0	0	109.5
514	Y	41.4	Very low	56.9	Low	299 Å²	299	124 Å²	124	100%	1.173	59%	0.59	S	S	*	*			trans	-60.4	0	179.5	-97.6	-104.8	0	0	0	112.9

Retrieved 514 of 514 residues in 71 ms (Link to these results)

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