A0A093I2I2_STRCA Loading...

Leucine-rich repeat-containing protein 4C

AlphaFold DB , UniProt , Accession A0A093I2I2, Species STRCA (Struthio camelus australis), Gene n/a, Length 624 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	38	Very low	32.8	Very low	239 Å²	239	167.8 Å²	167.8	100%	1.177	85%	0.854	S	S	*	*				0	107.8	0	-67	166.4	176.6	0	0	106.6
2	L	32.6	Very low	32.6	Very low	155 Å²	155	167.4 Å²	167.4	81%	0.812	85%	0.853	S	S	*	*				79.6	91.1	80.9	-102.9	164.3	0	0	0	113.7
3	N	30.2	Very low	32.7	Very low	149 Å²	149	168.3 Å²	168.3	80%	0.797	86%	0.855	S	S	*	*			trans	29.4	127.5	147.7	-57.4	-0.1	0	0	0	120.9
4	K	33.8	Very low	32.9	Very low	215 Å²	215	167.9 Å²	167.9	94%	0.935	85%	0.853	S	S	*	*				-143.7	147.4	116.9	-114.3	174.5	-176.3	178.8	0	110.9
5	M	29.4	Very low	33.1	Very low	185 Å²	185	160.5 Å²	160.5	91%	0.911	84%	0.836	S	S	*	*			trans	-153.2	156.1	-169.8	-164.9	179.2	-170.8	0	0	109
6	S	30.8	Very low	33.4	Very low	111 Å²	111	158.6 Å²	158.6	78%	0.776	84%	0.836	S	S	*	*			trans	68.3	155.2	-176.2	-100.3	0	0	0	0	115.8
7	L	31.3	Very low	33.7	Very low	160 Å²	160	163.4 Å²	163.4	84%	0.838	84%	0.84	S	S	*	*			cis	-138.3	161.9	12.2	-138.5	138.3	0	0	0	112.5
8	H	30.9	Very low	34.2	Very low	156 Å²	156	165.6 Å²	165.6	72%	0.722	84%	0.843	S	S	*	*			trans	-83.3	173.7	178.7	-124.8	42.9	0	0	0	112.7
9	P	38.6	Very low	34.5	Very low	113 Å²	113	164.6 Å²	164.6	73%	0.734	84%	0.84	S	S	*	*				-137.6	132.5	112.4	36.2	-25.6	0	0	0	116.5
10	Q	30.8	Very low	35.2	Very low	184 Å²	184	168.5 Å²	168.5	86%	0.86	84%	0.844	S	S	*	*			trans	67.9	144.1	142.9	-64.9	-178.9	-20.9	0	0	121.6
11	Q	34.1	Very low	35.8	Very low	179 Å²	179	164 Å²	164	84%	0.836	83%	0.833	S	S	*	*			trans	-110	154.2	-174.3	-55.1	157.8	-63.4	0	0	110.6
12	I	30.3	Very low	36.4	Very low	163 Å²	163	159.3 Å²	159.3	84%	0.836	81%	0.812	S	S	*	*			trans	-133.5	130.5	150	-60.6	-177.5	0	0	0	107.8
13	M	34.2	Very low	37.3	Very low	179 Å²	179	160.9 Å²	160.9	88%	0.882	81%	0.812	S	S	*	*			trans	-83.6	137.7	176.6	-66	-169	-67.4	0	0	111.4
14	I	35.3	Very low	38.7	Very low	162 Å²	162	157.8 Å²	157.8	83%	0.831	80%	0.796	S	S	*	*			trans	-134.2	138.3	160.7	-59.8	-177.6	0	0	0	107.8
15	G	35.6	Very low	40	Very low	57 Å²	57	152.1 Å²	152.1	59%	0.588	78%	0.781	S	S	*	*			trans	-72.9	-177	-168.2	0	0	0	0	0	116.6	R17	G15-R17 PolarHBondContact O-N 3.21Å
16	P	38.6	Very low	41.7	Very low	130 Å²	130	149 Å²	149	84%	0.844	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-64.3	132.2	-172.6	26.5	-34.8	0	0	0	112.4	F18	P16-F18 PolarHBondContact O-N 3.08Å
17	R	38	Very low	43.3	Very low	240 Å²	240	147.7 Å²	147.7	91%	0.906	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-71.1	120.2	174	-72.6	179.7	172.3	173.4	-2.6	110.1	G15 N19	G15-R17 PolarHBondContact O-N 3.21Å; R17-N19 PolarHBondContact O-N 2.97Å
18	F	42.5	Very low	45.1	Very low	203 Å²	203	144.1 Å²	144.1	89%	0.89	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-56.3	133.2	164.5	-109.9	-104.1	0	0	0	110.3	P16 R20	P16-F18 PolarHBondContact O-N 3.08Å; F18-R20 PolarHBondContact O-N 3.01Å
19	N	41.1	Very low	47.2	Very low	147 Å²	147	140.5 Å²	140.5	79%	0.786	73%	0.725	S	S	*	*			trans	-65.1	115.3	179.7	-88.9	-21.6	0	0	0	111.1	R17 A21	R17-N19 PolarHBondContact O-N 2.97Å; N19-A21 PolarHBondContact O-N 2.91Å
20	R	47.4	Very low	48.8	Very low	243 Å²	243	139.4 Å²	139.4	92%	0.917	71%	0.712	S	S	*	*			trans	-77	50.5	172.1	-74.2	-174.1	168.4	-173.5	-3.9	112.4	F18 L22	F18-R20 PolarHBondContact O-N 3.01Å; R20-L22 VanDerWaalsContact C-N 3.29Å; R20-L22 PolarHBondContact O-N 2.89Å
21	A	48.2	Very low	50.8	Low	74 Å²	74	135 Å²	135	61%	0.612	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	27.2	179.1	0	0	0	0	0	113.3	N19	N19-A21 PolarHBondContact O-N 2.91Å
22	L	51.1	Low	52.3	Low	140 Å²	140	128.5 Å²	128.5	73%	0.733	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	5.3	-173.8	-93.5	163.9	0	0	0	114	R20	R20-L22 VanDerWaalsContact C-N 3.29Å; R20-L22 PolarHBondContact O-N 2.89Å
23	F	51.3	Low	54.2	Low	188 Å²	188	125.6 Å²	125.6	83%	0.825	66%	0.657	S	S	*	*			trans	-132.8	30.1	-179	-79.5	-80	0	0	0	112.5	P25	F23-P25 WeakPolarHBondContact O-CD 3.28Å
24	D	58.8	Low	55.6	Low	84 Å²	84	122.6 Å²	122.6	45%	0.449	64%	0.64	S	S	.	*			trans	-76.7	114.9	163.9	-172.8	-27.8	0	0	0	108.3	L26 L27 V28	D24-L26 PolarHBondContact O-N 2.8Å; D24-L26 WeakPolarHBondContact OD1-CA 3.27Å; D24-L26 WeakPolarHBondContact OD1-CB 3.38Å; D24-L26 PolarHBondContact OD1-N 3.21Å; D24-L27 HydrophobicContact CB-CB 3.96Å; D24-L27 PolarHBondContact O-N 3.39Å; D24-L27 VanDerWaalsContact O-N 3.15Å; D24-V28 PolarHBondContact O-N 2.98Å; D24-V28 VanDerWaalsContact O-N 3.09Å
25	P	61.3	Low	56.8	Low	96 Å²	96	120.7 Å²	120.7	62%	0.623	63%	0.632	S	S	*	*	H	α-helix	trans	-63.4	-27.1	-179.9	28	-35.2	0	0	0	112.1	F23 V29	F23-P25 WeakPolarHBondContact O-CD 3.28Å; P25-V29 VanDerWaalsContact O-CB 3.31Å; P25-V29 WeakPolarHBondContact O-CB 3.4Å; P25-V29 VanDerWaalsContact O-CG2 3.22Å; P25-V29 WeakPolarHBondContact O-CG2 3.22Å; P25-V29 PolarHBondContact O-N 2.88Å
26	L	64.9	Low	57.9	Low	120 Å²	120	124 Å²	124	63%	0.628	64%	0.635	S	S	*	*	H	α-helix	trans	-67.8	-40.3	175.8	-157.3	87.1	0	0	0	110.9	D24 V29 L30	D24-L26 PolarHBondContact O-N 2.8Å; D24-L26 WeakPolarHBondContact OD1-CA 3.27Å; D24-L26 WeakPolarHBondContact OD1-CB 3.38Å; D24-L26 PolarHBondContact OD1-N 3.21Å; L26-V29 PolarHBondContact O-N 3.09Å; L26-L30 WeakPolarHBondContact O-CB 3.38Å; L26-L30 PolarHBondContact O-N 3.06Å
27	L	64.9	Low	58.7	Low	84 Å²	84	122 Å²	122	44%	0.44	62%	0.62	S	S	.	*	H	α-helix	trans	-67.7	-41.4	176.7	-172.7	70.8	0	0	0	111.5	D24 L30 L31	D24-L27 HydrophobicContact CB-CB 3.96Å; D24-L27 PolarHBondContact O-N 3.39Å; D24-L27 VanDerWaalsContact O-N 3.15Å; L27-L30 PolarHBondContact O-N 3.22Å; L27-L31 HydrophobicContact CG-CD1 4.27Å; L27-L31 WeakPolarHBondContact O-CB 3.44Å; L27-L31 WeakPolarHBondContact O-CG 3.4Å; L27-L31 PolarHBondContact O-N 2.74Å
28	V	70.3	Confident	59.4	Low	84 Å²	84	114.5 Å²	114.5	51%	0.509	60%	0.601	S	S	.	*	H	α-helix	trans	-65.3	-40.4	175.2	177.4	0	0	0	0	110.9	D24 L31 A32	D24-V28 PolarHBondContact O-N 2.98Å; D24-V28 VanDerWaalsContact O-N 3.09Å; V28-L31 PolarHBondContact O-N 2.91Å; V28-A32 VanDerWaalsContact O-CB 3.24Å; V28-A32 WeakPolarHBondContact O-CB 3.38Å; V28-A32 PolarHBondContact O-N 2.84Å
29	V	73.4	Confident	59.8	Low	81 Å²	81	107.9 Å²	107.9	49%	0.491	58%	0.584	S	S	.	*	H	α-helix	trans	-66.8	-38.3	173.9	167.1	0	0	0	0	111.7	P25 L26 A32 L33	P25-V29 VanDerWaalsContact O-CB 3.31Å; P25-V29 WeakPolarHBondContact O-CB 3.4Å; P25-V29 VanDerWaalsContact O-CG2 3.22Å; P25-V29 WeakPolarHBondContact O-CG2 3.22Å; P25-V29 PolarHBondContact O-N 2.88Å; L26-V29 PolarHBondContact O-N 3.09Å; V29-A32 PolarHBondContact O-N 2.91Å; V29-L33 HydrophobicContact CG1-CD1 3.69Å; V29-L33 WeakPolarHBondContact O-CB 3.34Å; V29-L33 VanDerWaalsContact O-CD1 3.29Å; V29-L33 WeakPolarHBondContact O-CD1 3.34Å; V29-L33 PolarHBondContact O-N 3.36Å
30	L	72.4	Confident	60.1	Low	90 Å²	90	103.6 Å²	103.6	47%	0.471	57%	0.574	S	S	.	*	H	α-helix	trans	-66	-42.6	174.5	-104.8	149.9	0	0	0	112.3	L26 L27 L33 Q34	L26-L30 WeakPolarHBondContact O-CB 3.38Å; L26-L30 PolarHBondContact O-N 3.06Å; L27-L30 PolarHBondContact O-N 3.22Å; L30-L33 PolarHBondContact O-N 2.95Å; L30-Q34 WeakPolarHBondContact O-CB 3.44Å; L30-Q34 WeakPolarHBondContact O-CG 3.4Å; L30-Q34 PolarHBondContact O-N 2.9Å
31	L	72.3	Confident	59.9	Low	90 Å²	90	98.4 Å²	98.4	47%	0.471	56%	0.564	S	S	.	*	H	α-helix	trans	-66.8	-36.4	173.5	-76.6	166.8	0	0	0	111.7	L27 V28 Q34 L35	L27-L31 HydrophobicContact CG-CD1 4.27Å; L27-L31 WeakPolarHBondContact O-CB 3.44Å; L27-L31 WeakPolarHBondContact O-CG 3.4Å; L27-L31 PolarHBondContact O-N 2.74Å; V28-L31 PolarHBondContact O-N 2.91Å; L31-Q34 PolarHBondContact O-N 2.85Å; L31-L35 VanDerWaalsContact O-CB 3.29Å; L31-L35 WeakPolarHBondContact O-CB 3.37Å; L31-L35 WeakPolarHBondContact O-CG 3.26Å; L31-L35 PolarHBondContact O-N 3.24Å
32	A	67.2	Low	59.7	Low	44 Å²	44	99.7 Å²	99.7	36%	0.364	56%	0.564	S	S	.	*	H	α-helix	trans	-68.7	-39.5	173.6	0	0	0	0	0	112.3	V28 V29 L35 L36	V28-A32 VanDerWaalsContact O-CB 3.24Å; V28-A32 WeakPolarHBondContact O-CB 3.38Å; V28-A32 PolarHBondContact O-N 2.84Å; V29-A32 PolarHBondContact O-N 2.91Å; A32-L35 PolarHBondContact O-N 2.64Å; A32-L36 WeakPolarHBondContact O-CB 3.48Å; A32-L36 VanDerWaalsContact O-CG 3.3Å; A32-L36 WeakPolarHBondContact O-CG 3.47Å; A32-L36 PolarHBondContact O-N 2.93Å
33	L	68.5	Low	59.4	Low	101 Å²	101	104 Å²	104	53%	0.529	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-40.8	171.7	-100.3	93.4	0	0	0	111.5	V29 L30 L36 V37	V29-L33 HydrophobicContact CG1-CD1 3.69Å; V29-L33 WeakPolarHBondContact O-CB 3.34Å; V29-L33 VanDerWaalsContact O-CD1 3.29Å; V29-L33 WeakPolarHBondContact O-CD1 3.34Å; V29-L33 PolarHBondContact O-N 3.36Å; L30-L33 PolarHBondContact O-N 2.95Å; L33-L36 PolarHBondContact O-N 3.2Å; L33-V37 WeakPolarHBondContact O-CB 3.25Å; L33-V37 VanDerWaalsContact O-CG2 3.28Å; L33-V37 WeakPolarHBondContact O-CG2 3.27Å; L33-V37 PolarHBondContact O-N 3.27Å
34	Q	65.1	Low	59.2	Low	116 Å²	116	98.6 Å²	98.6	54%	0.542	56%	0.561	S	S	.	*	H	α-helix	trans	-66.4	-37.4	174.6	-75.9	-174.8	-4.4	0	0	111.5	L30 L31 V37 V38	L30-Q34 WeakPolarHBondContact O-CB 3.44Å; L30-Q34 WeakPolarHBondContact O-CG 3.4Å; L30-Q34 PolarHBondContact O-N 2.9Å; L31-Q34 PolarHBondContact O-N 2.85Å; Q34-V37 PolarHBondContact O-N 2.95Å; Q34-V38 VanDerWaalsContact O-CB 3.27Å; Q34-V38 WeakPolarHBondContact O-CB 3.48Å; Q34-V38 WeakPolarHBondContact O-CG2 3.46Å; Q34-V38 PolarHBondContact O-N 3.07Å
35	L	59.6	Low	59.3	Low	123 Å²	123	99.3 Å²	99.3	64%	0.644	56%	0.561	S	S	*	*	H	α-helix	trans	-66.9	-34.9	171.3	-80.8	164	0	0	0	112.5	L31 A32 A39	L31-L35 VanDerWaalsContact O-CB 3.29Å; L31-L35 WeakPolarHBondContact O-CB 3.37Å; L31-L35 WeakPolarHBondContact O-CG 3.26Å; L31-L35 PolarHBondContact O-N 3.24Å; A32-L35 PolarHBondContact O-N 2.64Å; L35-A39 WeakPolarHBondContact O-CB 3.26Å; L35-A39 PolarHBondContact O-N 2.84Å
36	L	58.1	Low	59.7	Low	127 Å²	127	98 Å²	98	67%	0.665	55%	0.551	S	S	*	*	H	α-helix	trans	-71.3	-37	173	-78.4	164.1	0	0	0	112.4	A32 L33 G40	A32-L36 WeakPolarHBondContact O-CB 3.48Å; A32-L36 VanDerWaalsContact O-CG 3.3Å; A32-L36 WeakPolarHBondContact O-CG 3.47Å; A32-L36 PolarHBondContact O-N 2.93Å; L33-L36 PolarHBondContact O-N 3.2Å; L36-G40 PolarHBondContact O-N 3.41Å
37	V	56.4	Low	60.5	Low	88 Å²	88	94.4 Å²	94.4	53%	0.533	54%	0.536	S	S	.	.	H	α-helix	trans	-70.5	-40.7	173.8	168.3	0	0	0	0	110.6	L33 Q34 G40 L41	L33-V37 WeakPolarHBondContact O-CB 3.25Å; L33-V37 VanDerWaalsContact O-CG2 3.28Å; L33-V37 WeakPolarHBondContact O-CG2 3.27Å; L33-V37 PolarHBondContact O-N 3.27Å; Q34-V37 PolarHBondContact O-N 2.95Å; V37-G40 CarbonylContact O-C 3.58Å; V37-G40 PolarHBondContact O-N 3.22Å; V37-L41 HydrophobicContact CG1-CD1 3.95Å; V37-L41 WeakPolarHBondContact O-CB 3.36Å; V37-L41 VanDerWaalsContact O-CG 3.27Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 3.12Å
38	V	53.7	Low	61.4	Low	82 Å²	82	90.9 Å²	90.9	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-67.2	-39.8	172.9	169.1	0	0	0	0	110.9	Q34 G40 L41 V42	Q34-V38 VanDerWaalsContact O-CB 3.27Å; Q34-V38 WeakPolarHBondContact O-CB 3.48Å; Q34-V38 WeakPolarHBondContact O-CG2 3.46Å; Q34-V38 PolarHBondContact O-N 3.07Å; V38-G40 VanDerWaalsContact C-N 3.28Å; V38-G40 PolarHBondContact O-N 3.29Å; V38-L41 CarbonylContact O-C 3.17Å; V38-L41 PolarHBondContact O-N 2.88Å; V38-V42 WeakPolarHBondContact O-CG2 3.49Å; V38-V42 PolarHBondContact O-N 2.91Å
39	A	50.1	Low	62.1	Low	64 Å²	64	92.9 Å²	92.9	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-68.5	-25.1	172.3	0	0	0	0	0	113	L35	L35-A39 WeakPolarHBondContact O-CB 3.26Å; L35-A39 PolarHBondContact O-N 2.84Å
40	G	47.1	Very low	62.8	Low	57 Å²	57	92 Å²	92	59%	0.588	53%	0.531	S	S	*	.	H	α-helix	trans	-78.2	-29	169.1	0	0	0	0	0	113.7	L36 V37 V38	L36-G40 PolarHBondContact O-N 3.41Å; V37-G40 CarbonylContact O-C 3.58Å; V37-G40 PolarHBondContact O-N 3.22Å; V38-G40 VanDerWaalsContact C-N 3.28Å; V38-G40 PolarHBondContact O-N 3.29Å
41	L	44	Very low	63.6	Low	134 Å²	134	88.4 Å²	88.4	70%	0.702	51%	0.513	S	S	*	.	H	α-helix	trans	-81.6	-31.1	175.2	-75.4	166.5	0	0	0	112.6	V37 V38 R43	V37-L41 HydrophobicContact CG1-CD1 3.95Å; V37-L41 WeakPolarHBondContact O-CB 3.36Å; V37-L41 VanDerWaalsContact O-CG 3.27Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 3.12Å; V38-L41 CarbonylContact O-C 3.17Å; V38-L41 PolarHBondContact O-N 2.88Å; L41-R43 PolarHBondContact O-N 3.06Å
42	V	43.6	Very low	64.5	Low	101 Å²	101	87.9 Å²	87.9	61%	0.612	52%	0.516	S	S	*	.	S	Bend	trans	-67.9	79.4	157.7	179	0	0	0	0	106.7	V38 A44	V38-V42 WeakPolarHBondContact O-CG2 3.49Å; V38-V42 PolarHBondContact O-N 2.91Å; V42-A44 PolarHBondContact O-N 2.87Å
43	R	45.2	Very low	65.6	Low	229 Å²	229	87.2 Å²	87.2	86%	0.864	51%	0.509	S	S	*	.			trans	-48.5	105.7	169.2	-82.1	179.2	166.6	166.2	-4.9	107.7	L41 Q45	L41-R43 PolarHBondContact O-N 3.06Å; R43-Q45 PolarHBondContact O-N 2.9Å
44	A	47.2	Very low	66.6	Low	75 Å²	75	84.9 Å²	84.9	62%	0.62	50%	0.501	S	S	*	.			trans	-49.9	129.4	175.2	0	0	0	0	0	107.6	V42 T46	V42-A44 PolarHBondContact O-N 2.87Å; A44-T46 VanDerWaalsContact C-N 3.26Å; A44-T46 PolarHBondContact O-N 3.35Å
45	Q	59.8	Low	67.2	Low	99 Å²	99	87.1 Å²	87.1	46%	0.463	52%	0.517	S	S	.	.			trans	-75.6	86.7	-172	-152	162.9	42	0	0	107.6	R43 F57 N77	R43-Q45 PolarHBondContact O-N 2.9Å; Q45-F57 HydrophobicContact CB-CD2 4.04Å; Q45-F57 HydrophobicContact CB-CE2 3.8Å; Q45-F57 HydrophobicContact CB-CZ 4.3Å; Q45-F57 HydrophobicContact CG-CD2 3.6Å; Q45-F57 HydrophobicContact CG-CE2 3.91Å; Q45-F57 HydrophobicContact CG-CG 4.16Å; Q45-F57 WeakPolarHBondContact O-CE1 3.44Å; Q45-F57 WeakPolarHBondContact O-CZ 3.32Å; Q45-N77 PolarHBondContact NE2-ND2 2.77Å; Q45-N77 VanDerWaalsContact NE2-ND2 3.15Å
46	T	69.9	Low	68.1	Low	68 Å²	68	88.2 Å²	88.2	42%	0.417	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-76.7	139.8	-164.2	39.4	0	0	0	0	112.5	A44 G73	A44-T46 VanDerWaalsContact C-N 3.26Å; A44-T46 PolarHBondContact O-N 3.35Å; T46-G73 WeakPolarHBondContact CB-O 3.45Å; T46-G73 VanDerWaalsContact O-O 3.14Å; T46-G73 PolarHBondContact OG1-O 2.69Å
47	C	81.1	Confident	69.2	Low	45 Å²	45	84.3 Å²	84.3	30%	0.304	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-91.8	133.9	150.6	-167.7	0	0	0	0	107.9	S49 C53 F57	C47-S49 PolarHBondContact O-N 3.27Å; C47-C53 WeakPolarHBondContact CA-SG 3.38Å; C47-C53 HydrophobicContact CB-CB 3.7Å; C47-C53 WeakPolarHBondContact CB-SG 3.2Å; C47-C53 WeakPolarHBondContact SG-CB 3.37Å; C47-C53 PolarHBondContact SG-N 3.44Å; C47-C53 CovalentContact SG-SG 2.03Å; C47-C53 PolarHBondContact SG-SG 3.26Å; C47-F57 HydrophobicContact CB-CD1 4.5Å; C47-F57 HydrophobicContact CB-CE1 4.21Å
48	P	85	Confident	70.7	Confident	11 Å²	11	81.2 Å²	81.2	7%	0.071	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-58.9	129.2	168.6	-20.1	31.1	0	0	0	109.5	V50 C51 P71 D72 I74	P48-V50 PolarHBondContact O-N 2.71Å; P48-C51 HydrophobicContact CB-CB 4.36Å; P48-C51 PolarHBondContact O-N 2.96Å; P48-P71 HydrophobicContact CB-CB 4.15Å; P48-D72 WeakPolarHBondContact CG-O 3.27Å; P48-I74 HydrophobicContact CG-CG1 3.82Å
49	S	84.5	Confident	72.4	Confident	125 Å²	125	83 Å²	83	87%	0.874	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.6	-170.8	55.9	0	0	0	0	115.2	C47	C47-S49 PolarHBondContact O-N 3.27Å
50	V	88.6	Confident	74.4	Confident	63 Å²	63	80 Å²	80	38%	0.382	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-22.8	176.9	-171.4	0	0	0	0	111.9	P48 K65 L67	P48-V50 PolarHBondContact O-N 2.71Å; V50-K65 HydrophobicContact CG1-CB 3.81Å; V50-K65 HydrophobicContact CG1-CD 4.02Å; V50-K65 HydrophobicContact CG1-CG 3.96Å; V50-K65 VanDerWaalsContact O-CD 3.29Å; V50-K65 WeakPolarHBondContact O-CD 3.28Å; V50-K65 WeakPolarHBondContact O-CE 3.28Å; V50-K65 PolarHBondContact O-NZ 3.07Å; V50-L67 HydrophobicContact CG1-CD2 4.17Å
51	C	89.6	Confident	76.6	Confident	15 Å²	15	80.4 Å²	80.4	10%	0.101	44%	0.443	C	S	.	.	S	Bend	trans	-101.9	172	-173.2	-56.5	0	0	0	0	112.5	P48 V60 I61 C62	P48-C51 HydrophobicContact CB-CB 4.36Å; P48-C51 PolarHBondContact O-N 2.96Å; C51-V60 HydrophobicContact CB-CG1 4.23Å; C51-I61 WeakPolarHBondContact CA-O 3.46Å; C51-I61 WeakPolarHBondContact CB-O 3.27Å; C51-C62 HydrophobicContact CB-CB 4.11Å; C51-C62 WeakPolarHBondContact CB-SG 3.21Å; C51-C62 WeakPolarHBondContact SG-CB 3.16Å; C51-C62 CovalentContact SG-SG 2.04Å; C51-C62 PolarHBondContact SG-SG 2.75Å
52	S	91.3	Very high	78.9	Confident	78 Å²	78	74 Å²	74	55%	0.545	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	138	169.8	-176.9	0	0	0	0	109.9	I61	S52-I61 PolarHBondContact N-O 2.91Å; S52-I61 PolarHBondContact O-N 2.91Å
53	C	90.3	Very high	81.2	Confident	30 Å²	30	70.7 Å²	70.7	20%	0.203	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145.5	-177.3	-56.2	0	0	0	0	111.2	C47 F57 K59 V60	C47-C53 WeakPolarHBondContact CA-SG 3.38Å; C47-C53 HydrophobicContact CB-CB 3.7Å; C47-C53 WeakPolarHBondContact CB-SG 3.2Å; C47-C53 WeakPolarHBondContact SG-CB 3.37Å; C47-C53 PolarHBondContact SG-N 3.44Å; C47-C53 CovalentContact SG-SG 2.03Å; C47-C53 PolarHBondContact SG-SG 3.26Å; C53-F57 HydrophobicContact CB-CD1 3.99Å; C53-F57 HydrophobicContact CB-CE1 4.43Å; C53-K59 WeakPolarHBondContact CA-O 3.37Å; C53-V60 HydrophobicContact CB-CG2 4.48Å
54	S	89.2	Confident	83.4	Confident	53 Å²	53	67.7 Å²	67.7	37%	0.371	38%	0.378	S	S	.	.			trans	-71.2	158	171.3	-175.9	0	0	0	0	111.6	Q56 F57 K59	S54-Q56 PolarHBondContact O-N 2.77Å; S54-F57 WeakPolarHBondContact O-CA 3.3Å; S54-F57 PolarHBondContact O-N 2.94Å; S54-K59 PolarHBondContact N-O 3.43Å; S54-K59 VanDerWaalsContact N-O 3.08Å
55	N	75.9	Confident	85.5	Confident	162 Å²	162	68.6 Å²	68.6	87%	0.866	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-12	-176.6	-57.4	9.8	0	0	0	115.6
56	Q	80.5	Confident	87	Confident	147 Å²	147	69 Å²	69	69%	0.687	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	9.5	174.1	-65.4	-178	-11.7	0	0	113.2	S54 S58	S54-Q56 PolarHBondContact O-N 2.77Å; Q56-S58 PolarHBondContact O-N 2.73Å
57	F	80.4	Confident	87.8	Confident	44 Å²	44	66.9 Å²	66.9	19%	0.193	36%	0.359	C	S	.	.	S	Bend	trans	55.5	13.7	-174.2	-50	-85.1	0	0	0	115.2	Q45 C47 C53 S54 K59 T78	Q45-F57 HydrophobicContact CB-CD2 4.04Å; Q45-F57 HydrophobicContact CB-CE2 3.8Å; Q45-F57 HydrophobicContact CB-CZ 4.3Å; Q45-F57 HydrophobicContact CG-CD2 3.6Å; Q45-F57 HydrophobicContact CG-CE2 3.91Å; Q45-F57 HydrophobicContact CG-CG 4.16Å; Q45-F57 WeakPolarHBondContact O-CE1 3.44Å; Q45-F57 WeakPolarHBondContact O-CZ 3.32Å; C47-F57 HydrophobicContact CB-CD1 4.5Å; C47-F57 HydrophobicContact CB-CE1 4.21Å; C53-F57 HydrophobicContact CB-CD1 3.99Å; C53-F57 HydrophobicContact CB-CE1 4.43Å; S54-F57 WeakPolarHBondContact O-CA 3.3Å; S54-F57 PolarHBondContact O-N 2.94Å; F57-K59 VanDerWaalsContact C-N 3.33Å; F57-K59 PolarHBondContact O-N 2.74Å; F57-T78 VanDerWaalsContact O-CA 3.25Å; F57-T78 WeakPolarHBondContact O-CA 3.35Å; F57-T78 PolarHBondContact O-OG1 2.9Å
58	S	87	Confident	88	Confident	23 Å²	23	73 Å²	73	16%	0.161	38%	0.376	C	S	.	.	S	Bend	trans	-73.6	-21.6	-177.3	59.2	0	0	0	0	113.9	Q56 R79 L80	Q56-S58 PolarHBondContact O-N 2.73Å; S58-R79 PolarHBondContact O-N 3.11Å; S58-L80 PolarHBondContact O-N 2.98Å; S58-L80 VanDerWaalsContact O-N 3.17Å
59	K	90.4	Very high	87.9	Confident	121 Å²	121	75.1 Å²	75.1	53%	0.526	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.5	169.9	-59.9	-174.5	178.1	-177.4	0	109	C53 S54 F57 L80	C53-K59 WeakPolarHBondContact CA-O 3.37Å; S54-K59 PolarHBondContact N-O 3.43Å; S54-K59 VanDerWaalsContact N-O 3.08Å; F57-K59 VanDerWaalsContact C-N 3.33Å; F57-K59 PolarHBondContact O-N 2.74Å; K59-L80 WeakPolarHBondContact CA-O 3.39Å; K59-L80 HydrophobicContact CG-CB 4.32Å
60	V	92.1	Very high	87.9	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.006	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	121.3	177.4	178.4	0	0	0	0	108.7	C51 C53 T78 L80 L81 N82	C51-V60 HydrophobicContact CB-CG1 4.23Å; C53-V60 HydrophobicContact CB-CG2 4.48Å; V60-T78 HydrophobicContact CB-CG2 4.02Å; V60-T78 HydrophobicContact CG2-CG2 3.69Å; V60-T78 VanDerWaalsContact CG2-OG1 3.23Å; V60-T78 WeakPolarHBondContact CG2-OG1 3.48Å; V60-L80 PolarHBondContact N-O 2.82Å; V60-L81 HydrophobicContact CB-CD1 4.02Å; V60-L81 HydrophobicContact CG1-CD1 3.91Å; V60-N82 PolarHBondContact O-N 2.86Å
61	I	93.1	Very high	87.6	Confident	64 Å²	64	67.3 Å²	67.3	33%	0.328	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.5	-170.3	-50.1	-59.9	0	0	0	109.6	C51 S52 V63 L80 N82	C51-I61 WeakPolarHBondContact CA-O 3.46Å; C51-I61 WeakPolarHBondContact CB-O 3.27Å; S52-I61 PolarHBondContact N-O 2.91Å; S52-I61 PolarHBondContact O-N 2.91Å; I61-V63 HydrophobicContact CG2-CB 4.36Å; I61-V63 HydrophobicContact CG2-CG2 3.79Å; I61-L80 HydrophobicContact CD1-CD2 3.82Å; I61-N82 HydrophobicContact CD1-CB 3.97Å
62	C	91.3	Very high	87.1	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.355	C	S	.	.			trans	-121.7	27.1	-175.2	-57.1	0	0	0	0	112.3	C51 K65 L67 N82 L83 N86	C51-C62 HydrophobicContact CB-CB 4.11Å; C51-C62 WeakPolarHBondContact CB-SG 3.21Å; C51-C62 WeakPolarHBondContact SG-CB 3.16Å; C51-C62 CovalentContact SG-SG 2.04Å; C51-C62 PolarHBondContact SG-SG 2.75Å; C62-K65 VanDerWaalsContact O-CG 3.28Å; C62-K65 WeakPolarHBondContact O-CG 3.25Å; C62-L67 HydrophobicContact CB-CD1 3.83Å; C62-N82 WeakPolarHBondContact CA-O 3.38Å; C62-N82 VanDerWaalsContact CB-O 3.31Å; C62-N82 WeakPolarHBondContact CB-O 3.49Å; C62-N82 PolarHBondContact N-O 2.79Å; C62-L83 HydrophobicContact CB-CD2 3.64Å; C62-L83 HydrophobicContact CB-CG 4.42Å; C62-N86 PolarHBondContact O-ND2 2.82Å
63	V	92.9	Very high	86.5	Confident	32 Å²	32	69 Å²	69	19%	0.194	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	137.6	-175.7	174.5	0	0	0	0	113.2	I61 K65 N82 H84	I61-V63 HydrophobicContact CG2-CB 4.36Å; I61-V63 HydrophobicContact CG2-CG2 3.79Å; V63-K65 VanDerWaalsContact C-N 3.25Å; V63-K65 WeakPolarHBondContact O-CG 3.02Å; V63-K65 PolarHBondContact O-N 3.26Å; V63-N82 WeakPolarHBondContact CG2-ND2 3.17Å; V63-N82 WeakPolarHBondContact CG2-OD1 3.35Å; V63-H84 WeakPolarHBondContact CA-O 3.38Å; V63-H84 WeakPolarHBondContact CG2-NE2 3.2Å
64	R	91.4	Very high	86.2	Confident	165 Å²	165	68.2 Å²	68.2	62%	0.623	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	35.1	173.4	-66.6	172.6	-171.8	141.8	14.9	114.1	H84 E85	R64-H84 PolarHBondContact N-O 2.9Å; R64-E85 VanDerWaalsContact CA-O 3.26Å; R64-E85 WeakPolarHBondContact CA-O 3.37Å; R64-E85 HydrophobicContact CG-CB 3.75Å; R64-E85 IonicContact CZ-OE1 3.29Å; R64-E85 VanDerWaalsContact CZ-OE1 3.29Å; R64-E85 IonicContact CZ-OE2 3.37Å; R64-E85 PolarHBondContact N-O 3.01Å; R64-E85 VanDerWaalsContact NE-CD 3.26Å; R64-E85 IonicContact NE-OE1 3.19Å; R64-E85 PolarHBondContact NE-OE1 3.28Å; R64-E85 IonicContact NE-OE2 2.72Å; R64-E85 PolarHBondContact NE-OE2 2.92Å; R64-E85 VanDerWaalsContact NH2-CD 3.34Å; R64-E85 IonicContact NH2-OE1 3.72Å; R64-E85 PolarHBondContact NH2-OE1 2.99Å; R64-E85 IonicContact NH2-OE2 2.89Å; R64-E85 PolarHBondContact NH2-OE2 2.83Å; R64-E85 VanDerWaalsContact NH2-OE2 3.16Å
65	K	90.4	Very high	85.9	Confident	95 Å²	95	66.1 Å²	66.1	41%	0.413	32%	0.322	S	S	.	.	S	Bend	trans	-95.4	2.3	-177.6	-64.2	-59.3	178.5	144.9	0	114.2	V50 C62 V63 L67 N86	V50-K65 HydrophobicContact CG1-CB 3.81Å; V50-K65 HydrophobicContact CG1-CD 4.02Å; V50-K65 HydrophobicContact CG1-CG 3.96Å; V50-K65 VanDerWaalsContact O-CD 3.29Å; V50-K65 WeakPolarHBondContact O-CD 3.28Å; V50-K65 WeakPolarHBondContact O-CE 3.28Å; V50-K65 PolarHBondContact O-NZ 3.07Å; C62-K65 VanDerWaalsContact O-CG 3.28Å; C62-K65 WeakPolarHBondContact O-CG 3.25Å; V63-K65 VanDerWaalsContact C-N 3.25Å; V63-K65 WeakPolarHBondContact O-CG 3.02Å; V63-K65 PolarHBondContact O-N 3.26Å; K65-L67 HydrophobicContact CB-CD1 3.96Å; K65-L67 HydrophobicContact CB-CG 3.79Å; K65-L67 PolarHBondContact O-N 2.81Å; K65-N86 WeakPolarHBondContact CA-OD1 2.99Å; K65-N86 PolarHBondContact N-OD1 2.93Å
66	N	91.1	Very high	86.2	Confident	106 Å²	106	62 Å²	62	57%	0.567	30%	0.302	S	S	*	.			trans	55.3	28.4	-174.6	-65.3	-59.9	0	0	0	113.7	R68 N86 Q87	N66-R68 PolarHBondContact O-N 2.88Å; N66-N86 PolarHBondContact N-OD1 3.1Å; N66-Q87 PolarHBondContact OD1-NE2 2.83Å
67	L	87.3	Confident	86.4	Confident	24 Å²	24	58.2 Å²	58.2	13%	0.126	29%	0.287	C	S	.	.			trans	-63.4	131.8	179.4	-67.7	165.8	0	0	0	110.4	V50 C62 K65 P71 L83 N86 Q87 I88	V50-L67 HydrophobicContact CG1-CD2 4.17Å; C62-L67 HydrophobicContact CB-CD1 3.83Å; K65-L67 HydrophobicContact CB-CD1 3.96Å; K65-L67 HydrophobicContact CB-CG 3.79Å; K65-L67 PolarHBondContact O-N 2.81Å; L67-P71 HydrophobicContact CD1-CG 4.21Å; L67-P71 HydrophobicContact CD2-CB 4.48Å; L67-L83 HydrophobicContact CD1-CD2 3.94Å; L67-N86 HydrophobicContact CB-CB 4.22Å; L67-N86 PolarHBondContact N-OD1 3.32Å; L67-Q87 CarbonylContact O-C 3.46Å; L67-Q87 VanDerWaalsContact O-CA 3.25Å; L67-Q87 WeakPolarHBondContact O-CA 3.34Å; L67-Q87 PolarHBondContact O-N 2.83Å; L67-I88 HydrophobicContact CB-CG1 4.35Å; L67-I88 WeakPolarHBondContact O-CG1 3.38Å; L67-I88 PolarHBondContact O-N 2.82Å; L67-I88 VanDerWaalsContact O-N 3.13Å
68	R	86.3	Confident	86.7	Confident	174 Å²	174	56.1 Å²	56.1	66%	0.657	28%	0.278	S	S	*	.	S	Bend	trans	-97	-16.9	175.7	-64.6	-178.4	178	178.9	0.2	113.3	N66 Q87 I88	N66-R68 PolarHBondContact O-N 2.88Å; R68-Q87 HydrophobicContact CG-CB 4.37Å; R68-I88 WeakPolarHBondContact O-CA 3.44Å
69	D	82.6	Confident	86.9	Confident	56 Å²	56	63 Å²	63	30%	0.299	30%	0.3	S	S	.	.	S	Bend	trans	-138.2	162.4	-178.7	-75.8	-63.3	0	0	0	108.6	K92	D69-K92 VanDerWaalsContact OD1-CD 3.27Å; D69-K92 WeakPolarHBondContact OD1-CD 3.47Å; D69-K92 WeakPolarHBondContact OD1-CE 3.37Å; D69-K92 IonicContact OD1-NZ 3.97Å; D69-K92 PolarHBondContact OD1-NZ 2.89Å; D69-K92 IonicContact OD2-NZ 3.89Å; D69-K92 PolarHBondContact OD2-NZ 2.95Å
70	V	84.5	Confident	87	Confident	6 Å²	6	59 Å²	59	4%	0.036	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-67	131.8	169.7	179.3	0	0	0	0	108.7	I74 L83 I91 F106	V70-I74 HydrophobicContact CG1-CD1 4.11Å; V70-L83 HydrophobicContact CG1-CD1 4.23Å; V70-L83 HydrophobicContact CG2-CD1 4.4Å; V70-I91 HydrophobicContact CG2-CD1 4.47Å; V70-I91 HydrophobicContact CG2-CG1 4.45Å; V70-I91 HydrophobicContact CG2-CG2 4.19Å; V70-F106 HydrophobicContact CG1-CE1 3.96Å; V70-F106 HydrophobicContact CG2-CE1 4.13Å; V70-F106 HydrophobicContact CG2-CZ 4.12Å
71	P	83.1	Confident	87	Confident	17 Å²	17	59 Å²	59	11%	0.11	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-76.2	138.6	-176	30.1	-34	0	0	0	112.2	P48 L67 I74 L83	P48-P71 HydrophobicContact CB-CB 4.15Å; L67-P71 HydrophobicContact CD1-CG 4.21Å; L67-P71 HydrophobicContact CD2-CB 4.48Å; P71-I74 HydrophobicContact CG-CD1 4.47Å; P71-I74 WeakPolarHBondContact O-CD1 3.4Å; P71-I74 WeakPolarHBondContact O-CG1 3.48Å; P71-L83 HydrophobicContact CG-CD2 4.1Å
72	D	78.9	Confident	87	Confident	100 Å²	100	56.4 Å²	56.4	54%	0.535	27%	0.271	S	S	.	.	S	Bend	trans	-72.2	161.8	178.8	-57.2	-28.9	0	0	0	112.5	P48 S95	P48-D72 WeakPolarHBondContact CG-O 3.27Å; D72-S95 WeakPolarHBondContact OD1-CB 3.16Å
73	G	77.1	Confident	87	Confident	29 Å²	29	56.4 Å²	56.4	30%	0.299	27%	0.271	S	S	.	.			trans	80.4	20.6	174.3	0	0	0	0	0	115.8	T46	T46-G73 WeakPolarHBondContact CB-O 3.45Å; T46-G73 VanDerWaalsContact O-O 3.14Å; T46-G73 PolarHBondContact OG1-O 2.69Å
74	I	84.1	Confident	86.9	Confident	14 Å²	14	56.1 Å²	56.1	7%	0.072	27%	0.268	C	S	.	.			trans	-68.6	139	173.5	-57.2	168.7	0	0	0	110.4	P48 V70 P71 L81 L109	P48-I74 HydrophobicContact CG-CG1 3.82Å; V70-I74 HydrophobicContact CG1-CD1 4.11Å; P71-I74 HydrophobicContact CG-CD1 4.47Å; P71-I74 WeakPolarHBondContact O-CD1 3.4Å; P71-I74 WeakPolarHBondContact O-CG1 3.48Å; I74-L81 HydrophobicContact CD1-CD1 3.98Å; I74-L81 HydrophobicContact CD1-CD2 3.84Å; I74-L109 HydrophobicContact CB-CD2 4.3Å; I74-L109 HydrophobicContact CG2-CD1 4.21Å; I74-L109 HydrophobicContact CG2-CD2 3.77Å
75	S	83.4	Confident	86.9	Confident	8 Å²	8	51.2 Å²	51.2	6%	0.056	25%	0.252	C	S	.	.			trans	-73.9	139.5	-179.2	-170.3	0	0	0	0	113.4	N77 T78 L109	S75-N77 PolarHBondContact O-N 2.98Å; S75-N77 VanDerWaalsContact O-N 3.11Å; S75-T78 VanDerWaalsContact O-CB 3.31Å; S75-T78 WeakPolarHBondContact O-CB 3.47Å; S75-T78 PolarHBondContact O-N 2.8Å; S75-T78 PolarHBondContact O-OG1 2.02Å; S75-L109 WeakPolarHBondContact O-CD2 3.28Å
76	T	82.4	Confident	87	Confident	75 Å²	75	47.2 Å²	47.2	46%	0.46	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-11.8	175.4	58.1	0	0	0	0	114	G108 N111	T76-G108 WeakPolarHBondContact CB-O 3.34Å; T76-G108 VanDerWaalsContact CG2-O 3.29Å; T76-G108 WeakPolarHBondContact CG2-O 3.2Å; T76-N111 PolarHBondContact O-ND2 3.47Å
77	N	84.3	Confident	87	Confident	69 Å²	69	44.7 Å²	44.7	37%	0.369	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-5.3	174.4	-78	-12.9	0	0	0	113.9	Q45 S75 R79	Q45-N77 PolarHBondContact NE2-ND2 2.77Å; Q45-N77 VanDerWaalsContact NE2-ND2 3.15Å; S75-N77 PolarHBondContact O-N 2.98Å; S75-N77 VanDerWaalsContact O-N 3.11Å; N77-R79 PolarHBondContact O-N 3.42Å
78	T	87.6	Confident	86.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.214	C	C	.	.			trans	-64.7	124.3	-179.8	-60.5	0	0	0	0	111.7	F57 V60 S75 L80 L81 N111 L112	F57-T78 VanDerWaalsContact O-CA 3.25Å; F57-T78 WeakPolarHBondContact O-CA 3.35Å; F57-T78 PolarHBondContact O-OG1 2.9Å; V60-T78 HydrophobicContact CB-CG2 4.02Å; V60-T78 HydrophobicContact CG2-CG2 3.69Å; V60-T78 VanDerWaalsContact CG2-OG1 3.23Å; V60-T78 WeakPolarHBondContact CG2-OG1 3.48Å; S75-T78 VanDerWaalsContact O-CB 3.31Å; S75-T78 WeakPolarHBondContact O-CB 3.47Å; S75-T78 PolarHBondContact O-N 2.8Å; S75-T78 PolarHBondContact O-OG1 2.02Å; T78-L80 WeakPolarHBondContact CG2-O 3.49Å; T78-L81 HydrophobicContact CG2-CB 4.17Å; T78-N111 CarbonylContact O-C 3.29Å; T78-L112 HydrophobicContact CG2-CD1 4.27Å; T78-L112 WeakPolarHBondContact O-CA 3.24Å; T78-L112 PolarHBondContact O-N 3.35Å
79	R	91.1	Very high	86.6	Confident	166 Å²	166	40.2 Å²	40.2	63%	0.626	21%	0.206	S	C	*	.	S	Bend	trans	-102	-30	177.9	-58.5	-176.1	-177.1	179.8	0.6	112.4	S58 N77 N111 N113 T114	S58-R79 PolarHBondContact O-N 3.11Å; N77-R79 PolarHBondContact O-N 3.42Å; R79-N111 WeakPolarHBondContact CA-O 3.24Å; R79-N113 PolarHBondContact O-N 2.98Å; R79-T114 PolarHBondContact O-N 2.96Å
80	L	92.9	Very high	86.2	Confident	38 Å²	38	42.9 Å²	42.9	20%	0.199	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.5	173	-176	157.7	0	0	0	108.9	S58 K59 V60 I61 T78 N82 T114	S58-L80 PolarHBondContact O-N 2.98Å; S58-L80 VanDerWaalsContact O-N 3.17Å; K59-L80 WeakPolarHBondContact CA-O 3.39Å; K59-L80 HydrophobicContact CG-CB 4.32Å; V60-L80 PolarHBondContact N-O 2.82Å; I61-L80 HydrophobicContact CD1-CD2 3.82Å; T78-L80 WeakPolarHBondContact CG2-O 3.49Å; L80-N82 HydrophobicContact CD2-CB 3.91Å; L80-T114 WeakPolarHBondContact CA-O 3.09Å; L80-T114 HydrophobicContact CD1-CG2 4.46Å; L80-T114 HydrophobicContact CG-CG2 4.43Å
81	L	92.1	Very high	85.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	114.4	172.6	176.4	59.5	0	0	0	108.6	V60 I74 T78 L83 F106 L109 L112 T114 L115 E116	V60-L81 HydrophobicContact CB-CD1 4.02Å; V60-L81 HydrophobicContact CG1-CD1 3.91Å; I74-L81 HydrophobicContact CD1-CD1 3.98Å; I74-L81 HydrophobicContact CD1-CD2 3.84Å; T78-L81 HydrophobicContact CG2-CB 4.17Å; L81-L83 HydrophobicContact CD1-CD1 4.26Å; L81-L83 HydrophobicContact CD1-CG 4.23Å; L81-L83 HydrophobicContact CD2-CD1 3.89Å; L81-L83 HydrophobicContact CG-CD1 3.91Å; L81-L83 HydrophobicContact CG-CG 4.23Å; L81-F106 HydrophobicContact CD2-CD1 4.09Å; L81-F106 HydrophobicContact CD2-CE1 3.92Å; L81-L109 HydrophobicContact CD2-CD1 4.07Å; L81-L112 HydrophobicContact CB-CD1 3.68Å; L81-T114 PolarHBondContact N-O 2.75Å; L81-T114 VanDerWaalsContact N-O 3.12Å; L81-L115 HydrophobicContact CB-CD1 4.17Å; L81-L115 HydrophobicContact CD2-CD1 4.02Å; L81-L115 HydrophobicContact CG-CD1 4.12Å; L81-E116 PolarHBondContact O-N 2.85Å
82	N	93.1	Very high	84.8	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.059	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.8	178.3	173	-23.6	0	0	0	110.3	V60 I61 C62 V63 L80 H84 E116	V60-N82 PolarHBondContact O-N 2.86Å; I61-N82 HydrophobicContact CD1-CB 3.97Å; C62-N82 WeakPolarHBondContact CA-O 3.38Å; C62-N82 VanDerWaalsContact CB-O 3.31Å; C62-N82 WeakPolarHBondContact CB-O 3.49Å; C62-N82 PolarHBondContact N-O 2.79Å; V63-N82 WeakPolarHBondContact CG2-ND2 3.17Å; V63-N82 WeakPolarHBondContact CG2-OD1 3.35Å; L80-N82 HydrophobicContact CD2-CB 3.91Å; N82-H84 PolarHBondContact ND2-CD2 2.83Å; N82-H84 PolarHBondContact ND2-NE2 2.96Å; N82-H84 PolarHBondContact OD1-CD2 2.68Å; N82-H84 PolarHBondContact OD1-N 2.7Å; N82-E116 HydrophobicContact CB-CB 4.26Å; N82-E116 WeakPolarHBondContact CB-OE2 3.5Å; N82-E116 PolarHBondContact ND2-OE2 3.18Å
83	L	91.1	Very high	83.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.			trans	-124.9	19.4	179.8	-73.7	159.7	0	0	0	111.5	C62 L67 V70 P71 L81 N86 I88 F106 E116 L117 N120	C62-L83 HydrophobicContact CB-CD2 3.64Å; C62-L83 HydrophobicContact CB-CG 4.42Å; L67-L83 HydrophobicContact CD1-CD2 3.94Å; V70-L83 HydrophobicContact CG1-CD1 4.23Å; V70-L83 HydrophobicContact CG2-CD1 4.4Å; P71-L83 HydrophobicContact CG-CD2 4.1Å; L81-L83 HydrophobicContact CD1-CD1 4.26Å; L81-L83 HydrophobicContact CD1-CG 4.23Å; L81-L83 HydrophobicContact CD2-CD1 3.89Å; L81-L83 HydrophobicContact CG-CD1 3.91Å; L81-L83 HydrophobicContact CG-CG 4.23Å; L83-N86 PolarHBondContact O-ND2 2.94Å; L83-I88 HydrophobicContact CB-CD1 4.21Å; L83-I88 HydrophobicContact CD2-CD1 4.27Å; L83-F106 HydrophobicContact CD1-CE1 4.37Å; L83-E116 CarbonylContact C-O 3.51Å; L83-E116 WeakPolarHBondContact CA-O 3.33Å; L83-E116 PolarHBondContact N-O 3.46Å; L83-L117 HydrophobicContact CB-CD2 3.95Å; L83-L117 HydrophobicContact CD1-CD2 3.95Å; L83-N120 PolarHBondContact O-ND2 3.25Å
84	H	91.3	Very high	82.5	Confident	26 Å²	26	50 Å²	50	12%	0.12	25%	0.246	C	C	.	.			trans	-72.3	161.5	-174.3	78.4	72.1	0	0	0	113.9	V63 R64 N82 N86 E116 F118	V63-H84 WeakPolarHBondContact CA-O 3.38Å; V63-H84 WeakPolarHBondContact CG2-NE2 3.2Å; R64-H84 PolarHBondContact N-O 2.9Å; N82-H84 PolarHBondContact ND2-CD2 2.83Å; N82-H84 PolarHBondContact ND2-NE2 2.96Å; N82-H84 PolarHBondContact OD1-CD2 2.68Å; N82-H84 PolarHBondContact OD1-N 2.7Å; H84-N86 PolarHBondContact O-ND2 3.1Å; H84-E116 IonicContact CD2-OE2 2.7Å; H84-F118 WeakPolarHBondContact CA-O 3.23Å; H84-F118 HydrophobicContact CB-CD1 3.73Å; H84-F118 HydrophobicContact CB-CD2 3.61Å; H84-F118 HydrophobicContact CB-CE1 3.7Å; H84-F118 HydrophobicContact CB-CE2 3.57Å; H84-F118 HydrophobicContact CB-CG 3.69Å; H84-F118 HydrophobicContact CB-CZ 3.63Å; H84-F118 WeakPolarHBondContact CB-O 3.35Å; H84-F118 AromaticContact CD2-CE1 3.52Å; H84-F118 AromaticContact CD2-CE2 3.72Å; H84-F118 AromaticContact CD2-CZ 3.1Å; H84-F118 WeakPolarHBondContact CD2-CZ 3.45Å; H84-F118 AromaticContact CG-CE1 3.79Å; H84-F118 AromaticContact CG-CE2 3.43Å; H84-F118 VanDerWaalsContact CG-CE2 3.43Å; H84-F118 AromaticContact CG-CZ 3.31Å; H84-F118 AromaticContact ND1-CE2 3.66Å; H84-F118 AromaticContact ND1-CZ 3.86Å; H84-F118 AromaticContact NE2-CZ 3.65Å
85	E	90.5	Very high	80.9	Confident	62 Å²	62	50.4 Å²	50.4	29%	0.29	25%	0.25	S	S	.	.	S	Bend	trans	53.3	55.2	-175.9	-68.4	179.5	-99.6	0	0	112.4	R64 F118 D119	R64-E85 VanDerWaalsContact CA-O 3.26Å; R64-E85 WeakPolarHBondContact CA-O 3.37Å; R64-E85 HydrophobicContact CG-CB 3.75Å; R64-E85 IonicContact CZ-OE1 3.29Å; R64-E85 VanDerWaalsContact CZ-OE1 3.29Å; R64-E85 IonicContact CZ-OE2 3.37Å; R64-E85 PolarHBondContact N-O 3.01Å; R64-E85 VanDerWaalsContact NE-CD 3.26Å; R64-E85 IonicContact NE-OE1 3.19Å; R64-E85 PolarHBondContact NE-OE1 3.28Å; R64-E85 IonicContact NE-OE2 2.72Å; R64-E85 PolarHBondContact NE-OE2 2.92Å; R64-E85 VanDerWaalsContact NH2-CD 3.34Å; R64-E85 IonicContact NH2-OE1 3.72Å; R64-E85 PolarHBondContact NH2-OE1 2.99Å; R64-E85 IonicContact NH2-OE2 2.89Å; R64-E85 PolarHBondContact NH2-OE2 2.83Å; R64-E85 VanDerWaalsContact NH2-OE2 3.16Å; E85-F118 PolarHBondContact N-O 3.36Å; E85-D119 VanDerWaalsContact CA-O 3.23Å; E85-D119 WeakPolarHBondContact CA-O 3.22Å; E85-D119 HydrophobicContact CB-CB 4.42Å; E85-D119 HydrophobicContact CG-CB 3.73Å; E85-D119 PolarHBondContact N-O 2.84Å
86	N	91.8	Very high	79.2	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.053	26%	0.258	C	S	.	.	S	Bend	trans	-128.1	-170.2	177.9	-81.9	-65.5	0	0	0	111	C62 K65 N66 L67 L83 H84 I88 D119 N120	C62-N86 PolarHBondContact O-ND2 2.82Å; K65-N86 WeakPolarHBondContact CA-OD1 2.99Å; K65-N86 PolarHBondContact N-OD1 2.93Å; N66-N86 PolarHBondContact N-OD1 3.1Å; L67-N86 HydrophobicContact CB-CB 4.22Å; L67-N86 PolarHBondContact N-OD1 3.32Å; L83-N86 PolarHBondContact O-ND2 2.94Å; H84-N86 PolarHBondContact O-ND2 3.1Å; N86-I88 HydrophobicContact CB-CD1 4.42Å; N86-I88 HydrophobicContact CB-CG1 4.2Å; N86-D119 PolarHBondContact N-O 2.65Å; N86-N120 VanDerWaalsContact C-OD1 3.24Å; N86-N120 WeakPolarHBondContact CB-OD1 3.25Å
87	Q	90.8	Very high	77.1	Confident	54 Å²	54	58.4 Å²	58.4	25%	0.252	28%	0.278	S	S	.	.			trans	-116.4	23.8	-175.9	-55.1	-173.4	13.8	0	0	111.6	N66 L67 R68 Q89	N66-Q87 PolarHBondContact OD1-NE2 2.83Å; L67-Q87 CarbonylContact O-C 3.46Å; L67-Q87 VanDerWaalsContact O-CA 3.25Å; L67-Q87 WeakPolarHBondContact O-CA 3.34Å; L67-Q87 PolarHBondContact O-N 2.83Å; R68-Q87 HydrophobicContact CG-CB 4.37Å; Q87-Q89 PolarHBondContact O-N 3.2Å
88	I	86.5	Confident	75	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.294	C	S	.	.			trans	-69.6	121.8	-174.1	-54.6	171.7	0	0	0	109	L67 R68 L83 N86 I91 N120 R121 L122	L67-I88 HydrophobicContact CB-CG1 4.35Å; L67-I88 WeakPolarHBondContact O-CG1 3.38Å; L67-I88 PolarHBondContact O-N 2.82Å; L67-I88 VanDerWaalsContact O-N 3.13Å; R68-I88 WeakPolarHBondContact O-CA 3.44Å; L83-I88 HydrophobicContact CB-CD1 4.21Å; L83-I88 HydrophobicContact CD2-CD1 4.27Å; N86-I88 HydrophobicContact CB-CD1 4.42Å; N86-I88 HydrophobicContact CB-CG1 4.2Å; I88-I91 HydrophobicContact CG2-CG1 4.2Å; I88-N120 VanDerWaalsContact CB-OD1 3.3Å; I88-N120 WeakPolarHBondContact CB-OD1 3.04Å; I88-N120 WeakPolarHBondContact CG1-OD1 3.44Å; I88-N120 PolarHBondContact N-OD1 2.82Å; I88-N120 VanDerWaalsContact N-OD1 3.09Å; I88-R121 CarbonylContact O-C 3.14Å; I88-R121 VanDerWaalsContact O-CA 3.27Å; I88-R121 WeakPolarHBondContact O-CA 3.17Å; I88-R121 WeakPolarHBondContact O-CB 3.34Å; I88-R121 PolarHBondContact O-N 3.44Å; I88-L122 HydrophobicContact CG2-CD2 4.06Å; I88-L122 PolarHBondContact O-N 2.76Å
89	Q	80.4	Confident	72.4	Confident	104 Å²	104	68.6 Å²	68.6	49%	0.486	33%	0.326	S	S	.	.			trans	-104	-41.3	-176.5	-70.4	170.3	38.9	0	0	112.7	Q87 R121	Q87-Q89 PolarHBondContact O-N 3.2Å; Q89-R121 HydrophobicContact CG-CB 3.7Å
90	I	74.3	Confident	69.6	Low	112 Å²	112	66.3 Å²	66.3	57%	0.574	33%	0.331	S	S	*	.			trans	-136	127.4	-176.3	-58.9	175.6	0	0	0	107.8	K92	I90-K92 HydrophobicContact CG2-CG 4.42Å; I90-K92 PolarHBondContact O-N 3.36Å
91	I	73.2	Confident	67	Low	8 Å²	8	71.9 Å²	71.9	4%	0.041	36%	0.359	C	S	.	.			trans	-88.3	94.3	173.3	-58.6	-163.3	0	0	0	108.1	V70 I88 V93 A105 F106 L117 L122 P126 A129	V70-I91 HydrophobicContact CG2-CD1 4.47Å; V70-I91 HydrophobicContact CG2-CG1 4.45Å; V70-I91 HydrophobicContact CG2-CG2 4.19Å; I88-I91 HydrophobicContact CG2-CG1 4.2Å; I91-V93 PolarHBondContact O-N 3.19Å; I91-A105 HydrophobicContact CG2-CB 3.28Å; I91-F106 HydrophobicContact CD1-CE2 4.09Å; I91-F106 HydrophobicContact CD1-CZ 3.97Å; I91-F106 HydrophobicContact CG2-CE2 4Å; I91-F106 HydrophobicContact CG2-CZ 4.24Å; I91-L117 HydrophobicContact CD1-CD1 3.77Å; I91-L117 HydrophobicContact CD1-CD2 4.05Å; I91-L122 HydrophobicContact CD1-CD1 4.32Å; I91-L122 HydrophobicContact CD1-CD2 4.23Å; I91-L122 HydrophobicContact CG1-CD2 3.8Å; I91-P126 HydrophobicContact CB-CB 3.94Å; I91-P126 HydrophobicContact CB-CG 3.99Å; I91-P126 HydrophobicContact CD1-CG 3.91Å; I91-P126 HydrophobicContact CG1-CG 4.09Å; I91-A129 HydrophobicContact CB-CB 4.3Å; I91-A129 HydrophobicContact CG2-CB 3.53Å
92	K	63.3	Low	64.7	Low	103 Å²	103	79.6 Å²	79.6	45%	0.448	40%	0.395	S	S	.	.			trans	-66.2	124	-173.5	-67.7	168.1	-179.2	155.3	0	112	D69 I90 N94 A105	D69-K92 VanDerWaalsContact OD1-CD 3.27Å; D69-K92 WeakPolarHBondContact OD1-CD 3.47Å; D69-K92 WeakPolarHBondContact OD1-CE 3.37Å; D69-K92 IonicContact OD1-NZ 3.97Å; D69-K92 PolarHBondContact OD1-NZ 2.89Å; D69-K92 IonicContact OD2-NZ 3.89Å; D69-K92 PolarHBondContact OD2-NZ 2.95Å; I90-K92 HydrophobicContact CG2-CG 4.42Å; I90-K92 PolarHBondContact O-N 3.36Å; K92-N94 PolarHBondContact O-N 2.9Å; K92-A105 VanDerWaalsContact O-CB 3.23Å; K92-A105 WeakPolarHBondContact O-CB 3.31Å
93	V	58.3	Low	62.7	Low	63 Å²	63	80.3 Å²	80.3	38%	0.382	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	44.5	178.1	-166.9	0	0	0	0	111.7	I91 I103	I91-V93 PolarHBondContact O-N 3.19Å; V93-I103 CarbonylContact C-O 3.29Å; V93-I103 WeakPolarHBondContact CA-O 3.42Å; V93-I103 WeakPolarHBondContact CG1-O 3.42Å
94	N	51	Low	61.1	Low	126 Å²	126	80.3 Å²	80.3	67%	0.674	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-163.4	4.8	-173.8	-95.3	-56.9	0	0	0	115.7	K92 F96	K92-N94 PolarHBondContact O-N 2.9Å; N94-F96 VanDerWaalsContact C-N 3.26Å; N94-F96 PolarHBondContact O-N 3.37Å
95	S	48.8	Very low	59.7	Low	24 Å²	24	79 Å²	79	17%	0.168	39%	0.393	C	S	.	.	S	Bend	trans	-57.2	-35.3	-178.2	-70.3	0	0	0	0	113.8	D72 K97	D72-S95 WeakPolarHBondContact OD1-CB 3.16Å; S95-K97 PolarHBondContact O-N 2.76Å
96	F	49.6	Very low	58.9	Low	50 Å²	50	76.1 Å²	76.1	22%	0.219	38%	0.379	C	S	.	.	S	Bend	trans	-93.3	86.5	178	-60.2	-54.2	0	0	0	112.5	N94 H98 A105	N94-F96 VanDerWaalsContact C-N 3.26Å; N94-F96 PolarHBondContact O-N 3.37Å; F96-H98 PolarHBondContact O-N 2.86Å; F96-H98 VanDerWaalsContact O-N 3.13Å; F96-A105 WeakPolarHBondContact CE2-O 3.37Å
97	K	37.7	Very low	57.8	Low	200 Å²	200	78.5 Å²	78.5	87%	0.87	39%	0.392	S	S	*	.			trans	-57.8	109.8	172.5	-86.1	-176.8	172.8	177.6	0	112.2	S95	S95-K97 PolarHBondContact O-N 2.76Å
98	H	39.5	Very low	56.8	Low	155 Å²	155	77.5 Å²	77.5	72%	0.718	40%	0.397	S	S	*	.	S	Bend		-178.2	153.2	96.9	-147.1	63.4	0	0	0	109.9	F96	F96-H98 PolarHBondContact O-N 2.86Å; F96-H98 VanDerWaalsContact O-N 3.13Å
99	L	33.7	Very low	56.4	Low	129 Å²	129	77.7 Å²	77.7	68%	0.675	40%	0.397	S	S	*	.	S	Bend	trans	64.4	100.1	173	-64.3	155.5	0	0	0	117.9
100	T	31.7	Very low	56.4	Low	117 Å²	117	74.9 Å²	74.9	72%	0.718	39%	0.392	S	S	*	.	S	Bend	trans	47.3	129.3	137.3	54.4	0	0	0	0	121.6
101	I	38.9	Very low	56.9	Low	155 Å²	155	72.1 Å²	72.1	80%	0.795	38%	0.378	S	S	*	.	S	Bend	trans	78.2	104.4	169	-49.1	169.4	0	0	0	114.4	I103	I101-I103 PolarHBondContact O-N 2.93Å
102	E	43.1	Very low	57.8	Low	163 Å²	163	71.8 Å²	71.8	76%	0.762	38%	0.377	S	S	*	.			trans	31.8	70.2	166.2	-61.4	-165.6	173.2	0	0	117.4	G104	E102-G104 PolarHBondContact O-N 3.09Å
103	I	50.7	Low	59.2	Low	25 Å²	25	69 Å²	69	13%	0.128	37%	0.367	C	S	.	.			trans	-90.9	100.6	177.7	-64.7	172.5	0	0	0	110.6	V93 I101 N107	V93-I103 CarbonylContact C-O 3.29Å; V93-I103 WeakPolarHBondContact CA-O 3.42Å; V93-I103 WeakPolarHBondContact CG1-O 3.42Å; I101-I103 PolarHBondContact O-N 2.93Å; I103-N107 HydrophobicContact CG2-CB 3.9Å
104	G	57.8	Low	61	Low	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.351	C	S	.	.			trans	-54.6	144.7	171.1	0	0	0	0	0	112.5	E102 F106 N107 G128	E102-G104 PolarHBondContact O-N 3.09Å; G104-F106 PolarHBondContact O-N 2.74Å; G104-N107 VanDerWaalsContact O-CB 3.26Å; G104-N107 WeakPolarHBondContact O-CB 3.18Å; G104-N107 PolarHBondContact O-N 2.79Å; G104-G128 WeakPolarHBondContact CA-O 3.22Å
105	A	63.1	Low	63	Low	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-10.2	-175.6	0	0	0	0	0	115	I91 K92 F96 A129	I91-A105 HydrophobicContact CG2-CB 3.28Å; K92-A105 VanDerWaalsContact O-CB 3.23Å; K92-A105 WeakPolarHBondContact O-CB 3.31Å; F96-A105 WeakPolarHBondContact CE2-O 3.37Å; A105-A129 HydrophobicContact CB-CB 4.09Å
106	F	73.1	Confident	65.2	Low	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	17.3	176.4	-58	-65.5	0	0	0	112.5	V70 L81 L83 I91 G104 L109 L115 L117 A129 F130 L133	V70-F106 HydrophobicContact CG1-CE1 3.96Å; V70-F106 HydrophobicContact CG2-CE1 4.13Å; V70-F106 HydrophobicContact CG2-CZ 4.12Å; L81-F106 HydrophobicContact CD2-CD1 4.09Å; L81-F106 HydrophobicContact CD2-CE1 3.92Å; L83-F106 HydrophobicContact CD1-CE1 4.37Å; I91-F106 HydrophobicContact CD1-CE2 4.09Å; I91-F106 HydrophobicContact CD1-CZ 3.97Å; I91-F106 HydrophobicContact CG2-CE2 4Å; I91-F106 HydrophobicContact CG2-CZ 4.24Å; G104-F106 PolarHBondContact O-N 2.74Å; F106-L109 HydrophobicContact CB-CD1 4.14Å; F106-L109 HydrophobicContact CD1-CD1 4.08Å; F106-L109 VanDerWaalsContact O-CB 3.29Å; F106-L109 WeakPolarHBondContact O-CB 3.09Å; F106-L109 WeakPolarHBondContact O-CG 3.41Å; F106-L109 PolarHBondContact O-N 2.92Å; F106-L115 HydrophobicContact CD2-CD2 4.21Å; F106-L115 HydrophobicContact CE1-CD1 4.21Å; F106-L115 HydrophobicContact CE1-CD2 4.44Å; F106-L115 HydrophobicContact CE2-CD2 3.84Å; F106-L115 HydrophobicContact CZ-CD1 4.23Å; F106-L115 HydrophobicContact CZ-CD2 3.97Å; F106-L117 HydrophobicContact CE2-CD1 4.48Å; F106-L117 HydrophobicContact CZ-CD1 4.19Å; F106-A129 HydrophobicContact CD2-CB 4.23Å; F106-A129 HydrophobicContact CE2-CB 4.29Å; F106-F130 HydrophobicContact CD2-CD1 4.39Å; F106-F130 HydrophobicContact CE2-CD1 4.43Å; F106-F130 HydrophobicContact CE2-CE1 4.28Å; F106-L133 HydrophobicContact CB-CD1 3.99Å; F106-L133 HydrophobicContact CB-CD2 3.93Å; F106-L133 HydrophobicContact CB-CG 4.34Å; F106-L133 HydrophobicContact CD2-CD1 4.27Å; F106-L133 HydrophobicContact CG-CD1 4.41Å
107	N	69.4	Low	67.3	Low	60 Å²	60	58.3 Å²	58.3	32%	0.321	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	146.5	180	-167	12.4	0	0	0	111.7	I103 G104 L109	I103-N107 HydrophobicContact CG2-CB 3.9Å; G104-N107 VanDerWaalsContact O-CB 3.26Å; G104-N107 WeakPolarHBondContact O-CB 3.18Å; G104-N107 PolarHBondContact O-N 2.79Å; N107-L109 PolarHBondContact O-N 3.46Å
108	G	68.3	Low	69.9	Low	34 Å²	34	50.6 Å²	50.6	35%	0.351	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-16.7	-172.8	0	0	0	0	0	114.9	T76 A110	T76-G108 WeakPolarHBondContact CB-O 3.34Å; T76-G108 VanDerWaalsContact CG2-O 3.29Å; T76-G108 WeakPolarHBondContact CG2-O 3.2Å; G108-A110 PolarHBondContact O-N 3.45Å
109	L	78	Confident	72.5	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.016	25%	0.252	C	S	.	.			trans	-79	45.4	177.2	-52.9	-174.5	0	0	0	112.6	I74 S75 L81 F106 N107 N111 L112 L133	I74-L109 HydrophobicContact CB-CD2 4.3Å; I74-L109 HydrophobicContact CG2-CD1 4.21Å; I74-L109 HydrophobicContact CG2-CD2 3.77Å; S75-L109 WeakPolarHBondContact O-CD2 3.28Å; L81-L109 HydrophobicContact CD2-CD1 4.07Å; F106-L109 HydrophobicContact CB-CD1 4.14Å; F106-L109 HydrophobicContact CD1-CD1 4.08Å; F106-L109 VanDerWaalsContact O-CB 3.29Å; F106-L109 WeakPolarHBondContact O-CB 3.09Å; F106-L109 WeakPolarHBondContact O-CG 3.41Å; F106-L109 PolarHBondContact O-N 2.92Å; N107-L109 PolarHBondContact O-N 3.46Å; L109-N111 PolarHBondContact O-N 2.63Å; L109-L112 HydrophobicContact CB-CB 4.17Å; L109-L112 HydrophobicContact CB-CD2 4.5Å; L109-L112 HydrophobicContact CD1-CD2 4.35Å; L109-L112 VanDerWaalsContact O-CB 3.24Å; L109-L112 WeakPolarHBondContact O-CB 3.21Å; L109-L112 PolarHBondContact O-N 2.89Å; L109-L133 HydrophobicContact CB-CD2 4.25Å
110	A	80.7	Confident	75.2	Confident	46 Å²	46	39.7 Å²	39.7	38%	0.38	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-0.4	-176	0	0	0	0	0	114.9	G108 K135	G108-A110 PolarHBondContact O-N 3.45Å; A110-K135 WeakPolarHBondContact O-CD 3.08Å; A110-K135 WeakPolarHBondContact O-CE 3.31Å; A110-K135 WeakPolarHBondContact O-CG 3.3Å; A110-K135 PolarHBondContact O-NZ 3.25Å
111	N	86.2	Confident	78.1	Confident	53 Å²	53	40.8 Å²	40.8	28%	0.283	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	0.3	173.6	-66.8	-56.3	0	0	0	113.9	T76 T78 R79 L109 N113 K135	T76-N111 PolarHBondContact O-ND2 3.47Å; T78-N111 CarbonylContact O-C 3.29Å; R79-N111 WeakPolarHBondContact CA-O 3.24Å; L109-N111 PolarHBondContact O-N 2.63Å; N111-N113 PolarHBondContact O-N 3.2Å; N111-K135 PolarHBondContact OD1-NZ 3.05Å
112	L	90.1	Very high	80.6	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	18%	0.175	C	C	.	.			trans	-66.6	127.1	-178.4	-164.6	66.8	0	0	0	110.8	T78 L81 L109 L115 L133 K135 L136	T78-L112 HydrophobicContact CG2-CD1 4.27Å; T78-L112 WeakPolarHBondContact O-CA 3.24Å; T78-L112 PolarHBondContact O-N 3.35Å; L81-L112 HydrophobicContact CB-CD1 3.68Å; L109-L112 HydrophobicContact CB-CB 4.17Å; L109-L112 HydrophobicContact CB-CD2 4.5Å; L109-L112 HydrophobicContact CD1-CD2 4.35Å; L109-L112 VanDerWaalsContact O-CB 3.24Å; L109-L112 WeakPolarHBondContact O-CB 3.21Å; L109-L112 PolarHBondContact O-N 2.89Å; L112-L115 HydrophobicContact CD2-CB 4.19Å; L112-L115 HydrophobicContact CD2-CD1 4.45Å; L112-L115 HydrophobicContact CD2-CD2 4.38Å; L112-L133 HydrophobicContact CD2-CD1 4.47Å; L112-L133 HydrophobicContact CD2-CD2 4.32Å; L112-K135 CarbonylContact O-C 3.47Å; L112-L136 HydrophobicContact CD2-CD1 4.18Å; L112-L136 HydrophobicContact CG-CD1 4.05Å; L112-L136 WeakPolarHBondContact O-CA 3.44Å; L112-L136 PolarHBondContact O-N 2.66Å; L112-L136 VanDerWaalsContact O-N 3.16Å
113	N	94.3	Very high	82.8	Confident	44 Å²	44	28.2 Å²	28.2	24%	0.235	15%	0.154	C	C	.	.			trans	-112.7	-37.1	-179.2	178.5	100.6	0	0	0	111.1	R79 N111 K137 E138	R79-N113 PolarHBondContact O-N 2.98Å; N111-N113 PolarHBondContact O-N 3.2Å; N113-K137 PolarHBondContact O-N 3.48Å; N113-K137 VanDerWaalsContact OD1-CD 3.31Å; N113-K137 WeakPolarHBondContact OD1-CD 3.21Å; N113-K137 WeakPolarHBondContact OD1-CE 3.37Å; N113-K137 PolarHBondContact OD1-NZ 2.79Å; N113-E138 PolarHBondContact O-N 3.48Å
114	T	95.5	Very high	84.6	Confident	10 Å²	10	31 Å²	31	6%	0.061	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.4	-176.4	-52.1	0	0	0	0	109.8	R79 L80 L81 E116 E138	R79-T114 PolarHBondContact O-N 2.96Å; L80-T114 WeakPolarHBondContact CA-O 3.09Å; L80-T114 HydrophobicContact CD1-CG2 4.46Å; L80-T114 HydrophobicContact CG-CG2 4.43Å; L81-T114 PolarHBondContact N-O 2.75Å; L81-T114 VanDerWaalsContact N-O 3.12Å; T114-E116 HydrophobicContact CG2-CG 4.39Å; T114-E138 WeakPolarHBondContact CA-O 3.43Å; T114-E138 HydrophobicContact CG2-CB 3.95Å; T114-E138 WeakPolarHBondContact CG2-OE2 3.42Å; T114-E138 PolarHBondContact OG1-OE2 3.32Å
115	L	94.1	Very high	86.1	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	115.6	179.2	176.8	56.1	0	0	0	110.1	L81 F106 L112 L117 F130 L136 E138 L139 W140	L81-L115 HydrophobicContact CB-CD1 4.17Å; L81-L115 HydrophobicContact CD2-CD1 4.02Å; L81-L115 HydrophobicContact CG-CD1 4.12Å; F106-L115 HydrophobicContact CD2-CD2 4.21Å; F106-L115 HydrophobicContact CE1-CD1 4.21Å; F106-L115 HydrophobicContact CE1-CD2 4.44Å; F106-L115 HydrophobicContact CE2-CD2 3.84Å; F106-L115 HydrophobicContact CZ-CD1 4.23Å; F106-L115 HydrophobicContact CZ-CD2 3.97Å; L112-L115 HydrophobicContact CD2-CB 4.19Å; L112-L115 HydrophobicContact CD2-CD1 4.45Å; L112-L115 HydrophobicContact CD2-CD2 4.38Å; L115-L117 HydrophobicContact CD1-CD1 4.21Å; L115-L117 HydrophobicContact CD1-CG 4.07Å; L115-L117 HydrophobicContact CD2-CD1 3.89Å; L115-L117 HydrophobicContact CG-CD1 3.9Å; L115-L117 HydrophobicContact CG-CG 4.1Å; L115-F130 HydrophobicContact CD2-CE1 4.21Å; L115-L136 HydrophobicContact CB-CD1 3.84Å; L115-E138 PolarHBondContact N-O 2.9Å; L115-L139 HydrophobicContact CB-CD1 4.19Å; L115-L139 HydrophobicContact CD2-CD1 4Å; L115-L139 HydrophobicContact CG-CD1 4.06Å; L115-W140 PolarHBondContact O-N 2.9Å
116	E	94.9	Very high	87	Confident	29 Å²	29	32.3 Å²	32.3	14%	0.136	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	109.8	-178.4	-66.9	154.6	-137.5	0	0	110.3	L81 N82 L83 H84 T114 F118 W140	L81-E116 PolarHBondContact O-N 2.85Å; N82-E116 HydrophobicContact CB-CB 4.26Å; N82-E116 WeakPolarHBondContact CB-OE2 3.5Å; N82-E116 PolarHBondContact ND2-OE2 3.18Å; L83-E116 CarbonylContact C-O 3.51Å; L83-E116 WeakPolarHBondContact CA-O 3.33Å; L83-E116 PolarHBondContact N-O 3.46Å; H84-E116 IonicContact CD2-OE2 2.7Å; T114-E116 HydrophobicContact CG2-CG 4.39Å; E116-F118 HydrophobicContact CB-CD1 4.04Å; E116-F118 HydrophobicContact CB-CE1 3.91Å; E116-F118 HydrophobicContact CG-CD1 4.44Å; E116-F118 HydrophobicContact CG-CE1 4.06Å; E116-W140 HydrophobicContact CG-CB 4.42Å; E116-W140 HydrophobicContact CG-CG 4.15Å
117	L	92.5	Very high	87.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.201	C	C	.	.			trans	-123.5	17.5	-178.4	-74.3	167	0	0	0	112	L83 I91 F106 L115 N120 L122 L139 W140 L141 N144	L83-L117 HydrophobicContact CB-CD2 3.95Å; L83-L117 HydrophobicContact CD1-CD2 3.95Å; I91-L117 HydrophobicContact CD1-CD1 3.77Å; I91-L117 HydrophobicContact CD1-CD2 4.05Å; F106-L117 HydrophobicContact CE2-CD1 4.48Å; F106-L117 HydrophobicContact CZ-CD1 4.19Å; L115-L117 HydrophobicContact CD1-CD1 4.21Å; L115-L117 HydrophobicContact CD1-CG 4.07Å; L115-L117 HydrophobicContact CD2-CD1 3.89Å; L115-L117 HydrophobicContact CG-CD1 3.9Å; L115-L117 HydrophobicContact CG-CG 4.1Å; L117-N120 PolarHBondContact O-ND2 3.08Å; L117-L122 HydrophobicContact CB-CD1 4.47Å; L117-L139 HydrophobicContact CD1-CD1 4.5Å; L117-W140 CarbonylContact C-O 3.28Å; L117-W140 WeakPolarHBondContact CA-O 3.41Å; L117-W140 PolarHBondContact N-O 3.11Å; L117-L141 HydrophobicContact CB-CD2 3.92Å; L117-L141 HydrophobicContact CD1-CD2 4.16Å; L117-N144 PolarHBondContact O-ND2 3.32Å
118	F	93	Very high	87.5	Confident	39 Å²	39	34.6 Å²	34.6	17%	0.171	20%	0.199	C	C	.	.			trans	-71.1	164.8	-179.7	63.2	-93.3	0	0	0	113.4	H84 E85 E116 N120 W140 R142	H84-F118 WeakPolarHBondContact CA-O 3.23Å; H84-F118 HydrophobicContact CB-CD1 3.73Å; H84-F118 HydrophobicContact CB-CD2 3.61Å; H84-F118 HydrophobicContact CB-CE1 3.7Å; H84-F118 HydrophobicContact CB-CE2 3.57Å; H84-F118 HydrophobicContact CB-CG 3.69Å; H84-F118 HydrophobicContact CB-CZ 3.63Å; H84-F118 WeakPolarHBondContact CB-O 3.35Å; H84-F118 AromaticContact CD2-CE1 3.52Å; H84-F118 AromaticContact CD2-CE2 3.72Å; H84-F118 AromaticContact CD2-CZ 3.1Å; H84-F118 WeakPolarHBondContact CD2-CZ 3.45Å; H84-F118 AromaticContact CG-CE1 3.79Å; H84-F118 AromaticContact CG-CE2 3.43Å; H84-F118 VanDerWaalsContact CG-CE2 3.43Å; H84-F118 AromaticContact CG-CZ 3.31Å; H84-F118 AromaticContact ND1-CE2 3.66Å; H84-F118 AromaticContact ND1-CZ 3.86Å; H84-F118 AromaticContact NE2-CZ 3.65Å; E85-F118 PolarHBondContact N-O 3.36Å; E116-F118 HydrophobicContact CB-CD1 4.04Å; E116-F118 HydrophobicContact CB-CE1 3.91Å; E116-F118 HydrophobicContact CG-CD1 4.44Å; E116-F118 HydrophobicContact CG-CE1 4.06Å; F118-N120 VanDerWaalsContact C-N 3.3Å; F118-N120 PolarHBondContact O-N 3.09Å; F118-N120 PolarHBondContact O-ND2 2.89Å; F118-W140 HydrophobicContact CD1-CB 3.96Å; F118-W140 PolarHBondContact N-O 3.1Å; F118-R142 VanDerWaalsContact CA-O 3.29Å; F118-R142 WeakPolarHBondContact CA-O 3.22Å; F118-R142 HydrophobicContact CB-CG 3.5Å; F118-R142 VanDerWaalsContact CB-O 3.28Å; F118-R142 WeakPolarHBondContact CB-O 3.28Å; F118-R142 HydrophobicContact CG-CG 4.19Å
119	D	93.4	Very high	87.8	Confident	46 Å²	46	33 Å²	33	25%	0.246	18%	0.182	C	C	.	.	S	Bend	trans	49.8	49.9	-177.5	-64.2	-38.5	0	0	0	112.3	E85 N86 R142 N143	E85-D119 VanDerWaalsContact CA-O 3.23Å; E85-D119 WeakPolarHBondContact CA-O 3.22Å; E85-D119 HydrophobicContact CB-CB 4.42Å; E85-D119 HydrophobicContact CG-CB 3.73Å; E85-D119 PolarHBondContact N-O 2.84Å; N86-D119 PolarHBondContact N-O 2.65Å; D119-R142 PolarHBondContact N-O 3.14Å; D119-R142 VanDerWaalsContact N-O 3.16Å; D119-N143 WeakPolarHBondContact OD1-CB 3.33Å; D119-N143 PolarHBondContact OD1-ND2 2.98Å
120	N	91.2	Very high	88	Confident	9 Å²	9	32.9 Å²	32.9	5%	0.048	18%	0.182	C	C	.	.	S	Bend	trans	-123.2	-165.4	178.7	-91.9	-83.6	0	0	0	110.8	L83 N86 I88 L117 F118 N144 P145	L83-N120 PolarHBondContact O-ND2 3.25Å; N86-N120 VanDerWaalsContact C-OD1 3.24Å; N86-N120 WeakPolarHBondContact CB-OD1 3.25Å; I88-N120 VanDerWaalsContact CB-OD1 3.3Å; I88-N120 WeakPolarHBondContact CB-OD1 3.04Å; I88-N120 WeakPolarHBondContact CG1-OD1 3.44Å; I88-N120 PolarHBondContact N-OD1 2.82Å; I88-N120 VanDerWaalsContact N-OD1 3.09Å; L117-N120 PolarHBondContact O-ND2 3.08Å; F118-N120 VanDerWaalsContact C-N 3.3Å; F118-N120 PolarHBondContact O-N 3.09Å; F118-N120 PolarHBondContact O-ND2 2.89Å; N120-N144 WeakPolarHBondContact CA-OD1 3.49Å; N120-N144 WeakPolarHBondContact CB-OD1 3.24Å; N120-N144 PolarHBondContact O-OD1 2.98Å; N120-P145 WeakPolarHBondContact O-CD 3.25Å
121	R	92.6	Very high	87.8	Confident	139 Å²	139	32.1 Å²	32.1	53%	0.525	17%	0.172	S	C	.	.			trans	-121.1	25.1	-174.4	-62.4	-174.6	175.9	-127.1	-3.2	113.2	I88 Q89 T123 N144	I88-R121 CarbonylContact O-C 3.14Å; I88-R121 VanDerWaalsContact O-CA 3.27Å; I88-R121 WeakPolarHBondContact O-CA 3.17Å; I88-R121 WeakPolarHBondContact O-CB 3.34Å; I88-R121 PolarHBondContact O-N 3.44Å; Q89-R121 HydrophobicContact CG-CB 3.7Å; R121-T123 PolarHBondContact O-N 3.13Å; R121-N144 PolarHBondContact N-OD1 3.29Å
122	L	90.4	Very high	87.1	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.01	19%	0.187	C	C	.	.			trans	-66.9	120.4	179.2	-56.5	176.1	0	0	0	110.6	I88 I91 L117 L141 N144 P145 I146	I88-L122 HydrophobicContact CG2-CD2 4.06Å; I88-L122 PolarHBondContact O-N 2.76Å; I91-L122 HydrophobicContact CD1-CD1 4.32Å; I91-L122 HydrophobicContact CD1-CD2 4.23Å; I91-L122 HydrophobicContact CG1-CD2 3.8Å; L117-L122 HydrophobicContact CB-CD1 4.47Å; L122-L141 HydrophobicContact CD1-CD2 3.85Å; L122-N144 HydrophobicContact CB-CB 4.23Å; L122-N144 WeakPolarHBondContact CB-OD1 3.45Å; L122-N144 WeakPolarHBondContact CG-OD1 2.99Å; L122-N144 PolarHBondContact N-OD1 3.38Å; L122-P145 CarbonylContact O-C 3.59Å; L122-P145 VanDerWaalsContact O-C 3.29Å; L122-P145 VanDerWaalsContact O-CD 3.27Å; L122-P145 WeakPolarHBondContact O-CD 3.03Å; L122-P145 WeakPolarHBondContact O-CG 3.47Å; L122-I146 VanDerWaalsContact O-CG1 3.31Å; L122-I146 WeakPolarHBondContact O-CG1 3.32Å; L122-I146 PolarHBondContact O-N 3.29Å
123	T	89.8	Confident	86.8	Confident	53 Å²	53	36.8 Å²	36.8	33%	0.325	19%	0.187	S	C	.	.	S	Bend	trans	-90	-18.1	177.2	53.4	0	0	0	0	113.5	R121 P145 I146 E147	R121-T123 PolarHBondContact O-N 3.13Å; T123-P145 HydrophobicContact CG2-CG 4.44Å; T123-I146 WeakPolarHBondContact O-CA 3.38Å; T123-E147 PolarHBondContact O-N 3.44Å
124	T	88.9	Confident	86.4	Confident	83 Å²	83	38.9 Å²	38.9	51%	0.509	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-141.2	158	-179.9	53.9	0	0	0	0	110.7	P126	T124-P126 WeakPolarHBondContact O-CD 3.01Å
125	I	89.2	Confident	86.2	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.041	22%	0.224	C	C	.	.			trans	-80	120.5	174.7	-67.5	160.6	0	0	0	109	N127 F130 I146 I149 A153 F154	I125-N127 VanDerWaalsContact C-N 3.28Å; I125-N127 PolarHBondContact O-N 3.07Å; I125-F130 HydrophobicContact CG2-CE2 3.94Å; I125-I146 HydrophobicContact CD1-CG2 4.5Å; I125-I146 HydrophobicContact CG1-CD1 4.03Å; I125-I146 HydrophobicContact CG1-CG2 4.23Å; I125-I149 HydrophobicContact CD1-CB 4.07Å; I125-I149 HydrophobicContact CD1-CD1 4.41Å; I125-I149 HydrophobicContact CD1-CG1 3.77Å; I125-I149 HydrophobicContact CD1-CG2 3.72Å; I125-A153 HydrophobicContact CD1-CB 4.5Å; I125-A153 HydrophobicContact CG2-CB 4.27Å; I125-F154 HydrophobicContact CD1-CE1 4.39Å; I125-F154 HydrophobicContact CD1-CE2 4.24Å; I125-F154 HydrophobicContact CD1-CZ 3.64Å; I125-F154 HydrophobicContact CG1-CZ 4.37Å; I125-F154 HydrophobicContact CG2-CD1 4.45Å; I125-F154 HydrophobicContact CG2-CE1 3.79Å; I125-F154 HydrophobicContact CG2-CZ 4.11Å
126	P	82.3	Confident	86.2	Confident	19 Å²	19	43.4 Å²	43.4	12%	0.123	22%	0.224	C	C	.	.			trans	-83.4	70.6	-175.2	34	-34.5	0	0	0	111	I91 T124 G128 A129 F130	I91-P126 HydrophobicContact CB-CB 3.94Å; I91-P126 HydrophobicContact CB-CG 3.99Å; I91-P126 HydrophobicContact CD1-CG 3.91Å; I91-P126 HydrophobicContact CG1-CG 4.09Å; T124-P126 WeakPolarHBondContact O-CD 3.01Å; P126-G128 PolarHBondContact O-N 2.92Å; P126-A129 HydrophobicContact CB-CB 3.92Å; P126-A129 HydrophobicContact CG-CB 4.29Å; P126-A129 WeakPolarHBondContact O-CB 3.36Å; P126-A129 PolarHBondContact O-N 3.29Å; P126-F130 HydrophobicContact CG-CE1 4.47Å; P126-F130 HydrophobicContact CG-CE2 4.18Å; P126-F130 HydrophobicContact CG-CZ 3.83Å; P126-F130 WeakPolarHBondContact O-CD2 3.37Å; P126-F130 WeakPolarHBondContact O-CE2 3.49Å
127	N	77.1	Confident	86.2	Confident	83 Å²	83	46 Å²	46	44%	0.444	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-48.7	-41.7	179.9	62	-10.8	0	0	0	113.6	I125 A129 F130 A153	I125-N127 VanDerWaalsContact C-N 3.28Å; I125-N127 PolarHBondContact O-N 3.07Å; N127-A129 VanDerWaalsContact C-N 3.28Å; N127-A129 PolarHBondContact O-N 2.73Å; N127-F130 PolarHBondContact O-N 3.21Å; N127-A153 WeakPolarHBondContact CB-O 3.46Å
128	G	74.9	Confident	86.5	Confident	26 Å²	26	47.8 Å²	47.8	27%	0.268	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-71.9	-10.4	176.3	0	0	0	0	0	115.5	G104 P126	G104-G128 WeakPolarHBondContact CA-O 3.22Å; P126-G128 PolarHBondContact O-N 2.92Å
129	A	75	Confident	86.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-84.4	-24.3	175.1	0	0	0	0	0	113.2	I91 A105 F106 P126 N127 V131	I91-A129 HydrophobicContact CB-CB 4.3Å; I91-A129 HydrophobicContact CG2-CB 3.53Å; A105-A129 HydrophobicContact CB-CB 4.09Å; F106-A129 HydrophobicContact CD2-CB 4.23Å; F106-A129 HydrophobicContact CE2-CB 4.29Å; P126-A129 HydrophobicContact CB-CB 3.92Å; P126-A129 HydrophobicContact CG-CB 4.29Å; P126-A129 WeakPolarHBondContact O-CB 3.36Å; P126-A129 PolarHBondContact O-N 3.29Å; N127-A129 VanDerWaalsContact C-N 3.28Å; N127-A129 PolarHBondContact O-N 2.73Å; A129-V131 VanDerWaalsContact C-N 3.34Å
130	F	81.4	Confident	86.9	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	23%	0.234	C	C	.	.	S	Bend	trans	-87.2	2.3	-174.4	-52.5	-53.3	0	0	0	114.6	F106 L115 I125 P126 N127 L133 L139 I157	F106-F130 HydrophobicContact CD2-CD1 4.39Å; F106-F130 HydrophobicContact CE2-CD1 4.43Å; F106-F130 HydrophobicContact CE2-CE1 4.28Å; L115-F130 HydrophobicContact CD2-CE1 4.21Å; I125-F130 HydrophobicContact CG2-CE2 3.94Å; P126-F130 HydrophobicContact CG-CE1 4.47Å; P126-F130 HydrophobicContact CG-CE2 4.18Å; P126-F130 HydrophobicContact CG-CZ 3.83Å; P126-F130 WeakPolarHBondContact O-CD2 3.37Å; P126-F130 WeakPolarHBondContact O-CE2 3.49Å; N127-F130 PolarHBondContact O-N 3.21Å; F130-L133 HydrophobicContact CB-CD1 4.36Å; F130-L133 HydrophobicContact CD1-CD1 4.24Å; F130-L133 WeakPolarHBondContact O-CB 3.36Å; F130-L133 PolarHBondContact O-N 3.5Å; F130-L139 HydrophobicContact CE1-CD1 4.23Å; F130-L139 HydrophobicContact CE1-CD2 4.24Å; F130-L139 HydrophobicContact CE2-CD2 4.38Å; F130-L139 HydrophobicContact CZ-CD1 4.48Å; F130-L139 HydrophobicContact CZ-CD2 4.03Å; F130-I157 HydrophobicContact CB-CD1 4.39Å; F130-I157 HydrophobicContact CB-CG2 3.86Å; F130-I157 HydrophobicContact CD2-CD1 4.48Å; F130-I157 HydrophobicContact CG-CD1 4.37Å; F130-I157 WeakPolarHBondContact O-CG2 3.46Å
131	V	76.3	Confident	87.1	Confident	29 Å²	29	46.2 Å²	46.2	18%	0.176	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	140.8	-179.6	-165.6	0	0	0	0	110.3	A129 L133 R156	A129-V131 VanDerWaalsContact C-N 3.34Å; V131-L133 VanDerWaalsContact C-N 3.28Å; V131-L133 PolarHBondContact O-N 3.42Å; V131-R156 HydrophobicContact CG2-CG 4.44Å
132	Y	73.2	Confident	87.2	Confident	151 Å²	151	42.5 Å²	42.5	59%	0.592	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.7	4.7	-177.9	-46	-66.7	0	0	0	117	S134	Y132-S134 PolarHBondContact O-N 2.79Å
133	L	83.8	Confident	87.5	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	23%	0.23	C	C	.	.			trans	-79	51.2	176.3	-62.6	-176.8	0	0	0	113.8	F106 L109 L112 F130 V131 K135 L136 I157	F106-L133 HydrophobicContact CB-CD1 3.99Å; F106-L133 HydrophobicContact CB-CD2 3.93Å; F106-L133 HydrophobicContact CB-CG 4.34Å; F106-L133 HydrophobicContact CD2-CD1 4.27Å; F106-L133 HydrophobicContact CG-CD1 4.41Å; L109-L133 HydrophobicContact CB-CD2 4.25Å; L112-L133 HydrophobicContact CD2-CD1 4.47Å; L112-L133 HydrophobicContact CD2-CD2 4.32Å; F130-L133 HydrophobicContact CB-CD1 4.36Å; F130-L133 HydrophobicContact CD1-CD1 4.24Å; F130-L133 WeakPolarHBondContact O-CB 3.36Å; F130-L133 PolarHBondContact O-N 3.5Å; V131-L133 VanDerWaalsContact C-N 3.28Å; V131-L133 PolarHBondContact O-N 3.42Å; L133-K135 PolarHBondContact O-N 3.5Å; L133-L136 HydrophobicContact CB-CB 4.11Å; L133-L136 HydrophobicContact CD1-CD2 4.19Å; L133-L136 WeakPolarHBondContact O-CB 3.43Å; L133-L136 PolarHBondContact O-N 3.1Å; L133-I157 HydrophobicContact CB-CG2 3.99Å
134	S	84.9	Confident	87.7	Confident	87 Å²	87	42.4 Å²	42.4	61%	0.608	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-9	-170.3	61.4	0	0	0	0	116.8	Y132 S159	Y132-S134 PolarHBondContact O-N 2.79Å; S134-S159 WeakPolarHBondContact O-CB 3.46Å; S134-S159 PolarHBondContact O-OG 2.89Å
135	K	90.8	Very high	87.9	Confident	105 Å²	105	40 Å²	40	46%	0.457	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-1.2	175.3	-59	-169.9	-159.8	167.7	0	113.8	A110 N111 L112 L133 K137	A110-K135 WeakPolarHBondContact O-CD 3.08Å; A110-K135 WeakPolarHBondContact O-CE 3.31Å; A110-K135 WeakPolarHBondContact O-CG 3.3Å; A110-K135 PolarHBondContact O-NZ 3.25Å; N111-K135 PolarHBondContact OD1-NZ 3.05Å; L112-K135 CarbonylContact O-C 3.47Å; L133-K135 PolarHBondContact O-N 3.5Å; K135-K137 PolarHBondContact O-N 3.5Å
136	L	94	Very high	88.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.			trans	-67.8	126.7	-177.4	-169.7	73.9	0	0	0	110	L112 L115 L133 L139 I157 S159 L160	L112-L136 HydrophobicContact CD2-CD1 4.18Å; L112-L136 HydrophobicContact CG-CD1 4.05Å; L112-L136 WeakPolarHBondContact O-CA 3.44Å; L112-L136 PolarHBondContact O-N 2.66Å; L112-L136 VanDerWaalsContact O-N 3.16Å; L115-L136 HydrophobicContact CB-CD1 3.84Å; L133-L136 HydrophobicContact CB-CB 4.11Å; L133-L136 HydrophobicContact CD1-CD2 4.19Å; L133-L136 WeakPolarHBondContact O-CB 3.43Å; L133-L136 PolarHBondContact O-N 3.1Å; L136-L139 HydrophobicContact CD2-CB 4.48Å; L136-I157 HydrophobicContact CD2-CD1 4.07Å; L136-I157 HydrophobicContact CD2-CG2 4.4Å; L136-S159 CarbonylContact O-C 3.4Å; L136-S159 VanDerWaalsContact O-C 3.25Å; L136-S159 WeakPolarHBondContact O-CB 3.48Å; L136-S159 PolarHBondContact O-OG 3.39Å; L136-L160 HydrophobicContact CD2-CD1 4.18Å; L136-L160 HydrophobicContact CG-CD1 4.12Å; L136-L160 WeakPolarHBondContact O-CA 3.34Å; L136-L160 PolarHBondContact O-N 3.42Å
137	K	96.6	Very high	88.8	Confident	85 Å²	85	42.6 Å²	42.6	37%	0.37	21%	0.211	S	C	.	.			trans	-116.6	-24.1	179.4	-64.6	-179.8	-157.7	138.5	0	112.6	N113 K135 R161 R162	N113-K137 PolarHBondContact O-N 3.48Å; N113-K137 VanDerWaalsContact OD1-CD 3.31Å; N113-K137 WeakPolarHBondContact OD1-CD 3.21Å; N113-K137 WeakPolarHBondContact OD1-CE 3.37Å; N113-K137 PolarHBondContact OD1-NZ 2.79Å; K135-K137 PolarHBondContact O-N 3.5Å; K137-R161 HydrophobicContact CB-CB 4.39Å; K137-R161 HydrophobicContact CB-CG 4.41Å; K137-R161 HydrophobicContact CG-CG 4.46Å; K137-R161 CarbonylContact O-C 3.42Å; K137-R161 WeakPolarHBondContact O-CA 3.3Å; K137-R161 PolarHBondContact O-N 3.46Å; K137-R162 PolarHBondContact O-N 3.46Å
138	E	98	Very high	89.6	Confident	36 Å²	36	40.5 Å²	40.5	17%	0.168	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	122.7	-171.7	-56.8	-179.8	147.8	0	0	110.1	N113 T114 L115 R162	N113-E138 PolarHBondContact O-N 3.48Å; T114-E138 WeakPolarHBondContact CA-O 3.43Å; T114-E138 HydrophobicContact CG2-CB 3.95Å; T114-E138 WeakPolarHBondContact CG2-OE2 3.42Å; T114-E138 PolarHBondContact OG1-OE2 3.32Å; L115-E138 PolarHBondContact N-O 2.9Å; E138-R162 WeakPolarHBondContact CA-O 3.46Å; E138-R162 HydrophobicContact CB-CB 4.44Å; E138-R162 HydrophobicContact CG-CB 4.1Å; E138-R162 HydrophobicContact CG-CG 4.14Å; E138-R162 IonicContact OE1-CZ 2.7Å; E138-R162 IonicContact OE1-NH1 3.22Å; E138-R162 PolarHBondContact OE1-NH1 3.08Å
139	L	96.6	Very high	90.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	118.1	-178.9	177.4	56.6	0	0	0	109.5	L115 L117 F130 L136 L141 F154 I157 L160 R162 L163 D164	L115-L139 HydrophobicContact CB-CD1 4.19Å; L115-L139 HydrophobicContact CD2-CD1 4Å; L115-L139 HydrophobicContact CG-CD1 4.06Å; L117-L139 HydrophobicContact CD1-CD1 4.5Å; F130-L139 HydrophobicContact CE1-CD1 4.23Å; F130-L139 HydrophobicContact CE1-CD2 4.24Å; F130-L139 HydrophobicContact CE2-CD2 4.38Å; F130-L139 HydrophobicContact CZ-CD1 4.48Å; F130-L139 HydrophobicContact CZ-CD2 4.03Å; L136-L139 HydrophobicContact CD2-CB 4.48Å; L139-L141 HydrophobicContact CD1-CD1 4.4Å; L139-L141 HydrophobicContact CD1-CG 4.17Å; L139-L141 HydrophobicContact CD2-CD1 4.01Å; L139-L141 HydrophobicContact CG-CD1 4.03Å; L139-L141 HydrophobicContact CG-CG 4.14Å; L139-F154 HydrophobicContact CD2-CD1 4.28Å; L139-F154 HydrophobicContact CD2-CE1 4.21Å; L139-I157 HydrophobicContact CD2-CD1 3.83Å; L139-L160 HydrophobicContact CB-CD1 3.77Å; L139-L160 HydrophobicContact CB-CD2 4.25Å; L139-R162 PolarHBondContact N-O 3.13Å; L139-L163 HydrophobicContact CB-CD1 4.27Å; L139-L163 HydrophobicContact CD2-CD1 4.18Å; L139-L163 HydrophobicContact CG-CD1 4.21Å; L139-D164 PolarHBondContact O-N 2.89Å
140	W	97.4	Very high	91.5	Very high	62 Å²	62	41.6 Å²	41.6	24%	0.235	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	108.7	-176.3	-50.2	86.1	0	0	0	110.1	L115 E116 L117 F118 D164	L115-W140 PolarHBondContact O-N 2.9Å; E116-W140 HydrophobicContact CG-CB 4.42Å; E116-W140 HydrophobicContact CG-CG 4.15Å; L117-W140 CarbonylContact C-O 3.28Å; L117-W140 WeakPolarHBondContact CA-O 3.41Å; L117-W140 PolarHBondContact N-O 3.11Å; F118-W140 HydrophobicContact CD1-CB 3.96Å; F118-W140 PolarHBondContact N-O 3.1Å; W140-D164 HydrophobicContact CD2-CB 4.16Å; W140-D164 HydrophobicContact CE3-CB 3.35Å; W140-D164 HydrophobicContact CZ3-CB 3.82Å
141	L	95.8	Very high	92.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.			trans	-117.3	3.1	-177.4	-73.2	167.1	0	0	0	112.9	L117 L122 L139 N144 F154 D164 L165	L117-L141 HydrophobicContact CB-CD2 3.92Å; L117-L141 HydrophobicContact CD1-CD2 4.16Å; L122-L141 HydrophobicContact CD1-CD2 3.85Å; L139-L141 HydrophobicContact CD1-CD1 4.4Å; L139-L141 HydrophobicContact CD1-CG 4.17Å; L139-L141 HydrophobicContact CD2-CD1 4.01Å; L139-L141 HydrophobicContact CG-CD1 4.03Å; L139-L141 HydrophobicContact CG-CG 4.14Å; L141-N144 PolarHBondContact O-ND2 2.85Å; L141-F154 HydrophobicContact CD1-CE1 4.17Å; L141-D164 WeakPolarHBondContact CA-O 3.33Å; L141-D164 PolarHBondContact N-O 2.87Å; L141-L165 HydrophobicContact CB-CD2 3.97Å; L141-L165 HydrophobicContact CD1-CD2 3.96Å
142	R	96.1	Very high	93	Very high	61 Å²	61	49.5 Å²	49.5	23%	0.23	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	150.2	-176.6	54.5	162.9	-87.7	101.3	8.3	115	F118 D119 N144 D164 G166 E167	F118-R142 VanDerWaalsContact CA-O 3.29Å; F118-R142 WeakPolarHBondContact CA-O 3.22Å; F118-R142 HydrophobicContact CB-CG 3.5Å; F118-R142 VanDerWaalsContact CB-O 3.28Å; F118-R142 WeakPolarHBondContact CB-O 3.28Å; F118-R142 HydrophobicContact CG-CG 4.19Å; D119-R142 PolarHBondContact N-O 3.14Å; D119-R142 VanDerWaalsContact N-O 3.16Å; R142-N144 PolarHBondContact O-N 3Å; R142-D164 WeakPolarHBondContact CB-OD2 3.32Å; R142-D164 WeakPolarHBondContact CD-OD2 3.37Å; R142-D164 WeakPolarHBondContact CG-OD2 3.34Å; R142-D164 PolarHBondContact N-O 3.39Å; R142-G166 CarbonylContact C-O 3.56Å; R142-G166 WeakPolarHBondContact CA-O 3.34Å; R142-G166 VanDerWaalsContact CB-O 3.24Å; R142-G166 WeakPolarHBondContact CB-O 3.29Å; R142-E167 IonicContact CZ-OE1 3.72Å; R142-E167 IonicContact NH1-OE1 2.92Å; R142-E167 PolarHBondContact NH1-OE1 3.23Å; R142-E167 IonicContact NH2-OE1 3.73Å; R142-E167 PolarHBondContact NH2-OE1 2.92Å
143	N	95.8	Very high	94	Very high	50 Å²	50	42.4 Å²	42.4	27%	0.267	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	39	-179.2	-165.7	45.4	0	0	0	113.9	D119 G166 E167 K169	D119-N143 WeakPolarHBondContact OD1-CB 3.33Å; D119-N143 PolarHBondContact OD1-ND2 2.98Å; N143-G166 PolarHBondContact N-O 2.97Å; N143-E167 HydrophobicContact CB-CB 3.86Å; N143-K169 PolarHBondContact OD1-NZ 3.41Å
144	N	92.9	Very high	94.4	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.016	22%	0.215	C	C	.	.			trans	-97	153.6	163.4	-84.3	-87.6	0	0	0	110.6	L117 N120 R121 L122 L141 R142 I146 L168	L117-N144 PolarHBondContact O-ND2 3.32Å; N120-N144 WeakPolarHBondContact CA-OD1 3.49Å; N120-N144 WeakPolarHBondContact CB-OD1 3.24Å; N120-N144 PolarHBondContact O-OD1 2.98Å; R121-N144 PolarHBondContact N-OD1 3.29Å; L122-N144 HydrophobicContact CB-CB 4.23Å; L122-N144 WeakPolarHBondContact CB-OD1 3.45Å; L122-N144 WeakPolarHBondContact CG-OD1 2.99Å; L122-N144 PolarHBondContact N-OD1 3.38Å; L141-N144 PolarHBondContact O-ND2 2.85Å; R142-N144 PolarHBondContact O-N 3Å; N144-I146 HydrophobicContact CB-CD1 4.05Å; N144-I146 HydrophobicContact CB-CG1 3.86Å; N144-I146 PolarHBondContact O-N 3.06Å; N144-L168 HydrophobicContact CB-CD2 4.15Å; N144-L168 WeakPolarHBondContact O-CD2 3.45Å
145	P	95.1	Very high	94.7	Very high	31 Å²	31	40.9 Å²	40.9	20%	0.201	20%	0.2	C	C	.	.			trans	-76.6	40.9	176.6	34.6	-37.7	0	0	0	113.1	N120 L122 T123 E147 R170	N120-P145 WeakPolarHBondContact O-CD 3.25Å; L122-P145 CarbonylContact O-C 3.59Å; L122-P145 VanDerWaalsContact O-C 3.29Å; L122-P145 VanDerWaalsContact O-CD 3.27Å; L122-P145 WeakPolarHBondContact O-CD 3.03Å; L122-P145 WeakPolarHBondContact O-CG 3.47Å; T123-P145 HydrophobicContact CG2-CG 4.44Å; P145-E147 PolarHBondContact O-N 3.32Å; P145-R170 HydrophobicContact CB-CG 4.49Å
146	I	94.9	Very high	94.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.207	C	C	.	.			trans	-67.9	128.3	-177	-63	171.2	0	0	0	109.9	L122 T123 I125 N144 S148 L168 R170 L171	L122-I146 VanDerWaalsContact O-CG1 3.31Å; L122-I146 WeakPolarHBondContact O-CG1 3.32Å; L122-I146 PolarHBondContact O-N 3.29Å; T123-I146 WeakPolarHBondContact O-CA 3.38Å; I125-I146 HydrophobicContact CD1-CG2 4.5Å; I125-I146 HydrophobicContact CG1-CD1 4.03Å; I125-I146 HydrophobicContact CG1-CG2 4.23Å; N144-I146 HydrophobicContact CB-CD1 4.05Å; N144-I146 HydrophobicContact CB-CG1 3.86Å; N144-I146 PolarHBondContact O-N 3.06Å; I146-S148 WeakPolarHBondContact CG2-O 3.3Å; I146-L168 HydrophobicContact CB-CD1 4.29Å; I146-L168 HydrophobicContact CB-CD2 4.13Å; I146-L168 HydrophobicContact CD1-CD1 4.27Å; I146-L168 HydrophobicContact CD1-CD2 3.94Å; I146-L168 HydrophobicContact CG1-CD2 4.18Å; I146-R170 CarbonylContact O-C 3.15Å; I146-L171 WeakPolarHBondContact O-CA 3.27Å; I146-L171 PolarHBondContact O-N 3.24Å
147	E	93.6	Very high	94.5	Very high	83 Å²	83	43.6 Å²	43.6	39%	0.388	21%	0.207	S	C	.	.			trans	-96.1	-26.5	-172.3	-61.8	-179	172.1	0	0	112.5	T123 P145 R170 S172	T123-E147 PolarHBondContact O-N 3.44Å; P145-E147 PolarHBondContact O-N 3.32Å; E147-R170 HydrophobicContact CG-CB 4.23Å; E147-R170 IonicContact OE1-NH1 3.16Å; E147-R170 PolarHBondContact OE1-NH1 3.29Å; E147-R170 VanDerWaalsContact OE1-NH1 3.16Å; E147-S172 PolarHBondContact O-N 2.82Å; E147-S172 PolarHBondContact O-OG 2.72Å
148	S	94.4	Very high	94.3	Very high	39 Å²	39	42.5 Å²	42.5	27%	0.273	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	157.1	175.1	59	0	0	0	0	114.4	I146 Y173	I146-S148 WeakPolarHBondContact CG2-O 3.3Å; S148-Y173 CarbonylContact C-O 3.24Å; S148-Y173 VanDerWaalsContact CA-O 3.25Å; S148-Y173 WeakPolarHBondContact CA-O 3.33Å
149	I	96.3	Very high	94.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	103.6	169.6	-50	-176.3	0	0	0	109.1	I125 A153 F154 L165 L171 Y173 I174 S175 A178 F179	I125-I149 HydrophobicContact CD1-CB 4.07Å; I125-I149 HydrophobicContact CD1-CD1 4.41Å; I125-I149 HydrophobicContact CD1-CG1 3.77Å; I125-I149 HydrophobicContact CD1-CG2 3.72Å; I149-A153 HydrophobicContact CG2-CB 4.08Å; I149-F154 HydrophobicContact CG2-CE2 4.16Å; I149-L165 HydrophobicContact CD1-CD1 4.05Å; I149-L171 HydrophobicContact CD1-CD2 4.18Å; I149-L171 HydrophobicContact CG1-CD1 3.94Å; I149-L171 HydrophobicContact CG1-CD2 4.46Å; I149-Y173 PolarHBondContact N-O 3.32Å; I149-I174 HydrophobicContact CB-CG1 4.43Å; I149-I174 HydrophobicContact CB-CG2 4.31Å; I149-I174 HydrophobicContact CD1-CD1 4.26Å; I149-I174 HydrophobicContact CD1-CG1 4.1Å; I149-I174 HydrophobicContact CG1-CG1 4.3Å; I149-S175 PolarHBondContact O-N 3.43Å; I149-A178 HydrophobicContact CB-CB 4.31Å; I149-A178 HydrophobicContact CG2-CB 3.61Å; I149-F179 HydrophobicContact CD1-CZ 4.43Å
150	P	94.8	Very high	94.1	Very high	49 Å²	49	42.1 Å²	42.1	32%	0.318	21%	0.21	S	C	.	.			trans	-76.1	165.5	-176.9	31.6	-35.8	0	0	0	112.7	A153 A178	P150-A153 HydrophobicContact CG-CB 4.17Å; P150-A153 WeakPolarHBondContact O-CB 3.22Å; P150-A153 PolarHBondContact O-N 3.03Å; P150-A178 WeakPolarHBondContact O-CA 3.41Å
151	S	94.9	Very high	94.1	Very high	60 Å²	60	45 Å²	45	42%	0.42	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	140	173.3	-40	0	0	0	0	111.5	A153 S175	S151-A153 PolarHBondContact O-N 2.92Å; S151-A153 VanDerWaalsContact O-N 3.15Å; S151-S175 PolarHBondContact OG-OG 2.03Å
152	Y	93.8	Very high	94.3	Very high	135 Å²	135	50.2 Å²	50.2	53%	0.529	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	22.2	177.5	-52.3	-72.4	0	0	0	115.3	F154 N155 G177 E180	Y152-F154 PolarHBondContact O-N 3.46Å; Y152-N155 HydrophobicContact CD1-CB 4.38Å; Y152-N155 WeakPolarHBondContact CD1-ND2 3.41Å; Y152-N155 WeakPolarHBondContact O-CB 3.43Å; Y152-N155 PolarHBondContact O-N 3.01Å; Y152-N155 VanDerWaalsContact O-N 3.07Å; Y152-G177 PolarHBondContact N-O 2.65Å; Y152-E180 HydrophobicContact CD1-CB 3.39Å; Y152-E180 HydrophobicContact CD1-CG 4.24Å; Y152-E180 HydrophobicContact CE1-CB 3.54Å; Y152-E180 HydrophobicContact CE1-CG 3.88Å; Y152-E180 HydrophobicContact CG-CB 4.47Å
153	A	92.8	Very high	94.4	Very high	3 Å²	3	47.3 Å²	47.3	3%	0.025	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-33	-174.4	0	0	0	0	0	114.5	I125 N127 I149 P150 S151	I125-A153 HydrophobicContact CD1-CB 4.5Å; I125-A153 HydrophobicContact CG2-CB 4.27Å; N127-A153 WeakPolarHBondContact CB-O 3.46Å; I149-A153 HydrophobicContact CG2-CB 4.08Å; P150-A153 HydrophobicContact CG-CB 4.17Å; P150-A153 WeakPolarHBondContact O-CB 3.22Å; P150-A153 PolarHBondContact O-N 3.03Å; S151-A153 PolarHBondContact O-N 2.92Å; S151-A153 VanDerWaalsContact O-N 3.15Å
154	F	93.6	Very high	94.5	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	6.2	-177	-50	-77	0	0	0	114.3	I125 L139 L141 I149 Y152 R156 I157 L163 L165 F179 L182	I125-F154 HydrophobicContact CD1-CE1 4.39Å; I125-F154 HydrophobicContact CD1-CE2 4.24Å; I125-F154 HydrophobicContact CD1-CZ 3.64Å; I125-F154 HydrophobicContact CG1-CZ 4.37Å; I125-F154 HydrophobicContact CG2-CD1 4.45Å; I125-F154 HydrophobicContact CG2-CE1 3.79Å; I125-F154 HydrophobicContact CG2-CZ 4.11Å; L139-F154 HydrophobicContact CD2-CD1 4.28Å; L139-F154 HydrophobicContact CD2-CE1 4.21Å; L141-F154 HydrophobicContact CD1-CE1 4.17Å; I149-F154 HydrophobicContact CG2-CE2 4.16Å; Y152-F154 PolarHBondContact O-N 3.46Å; F154-R156 PolarHBondContact O-N 3.14Å; F154-I157 HydrophobicContact CB-CG1 4.22Å; F154-I157 HydrophobicContact CD1-CD1 4.36Å; F154-I157 WeakPolarHBondContact O-CG1 3.22Å; F154-I157 PolarHBondContact O-N 3.32Å; F154-L163 HydrophobicContact CD1-CD2 4.47Å; F154-L163 HydrophobicContact CD2-CD2 4.02Å; F154-L163 HydrophobicContact CE1-CD1 4.03Å; F154-L163 HydrophobicContact CE1-CD2 4.31Å; F154-L163 HydrophobicContact CE2-CD2 3.85Å; F154-L163 HydrophobicContact CG-CD2 4.32Å; F154-L163 HydrophobicContact CZ-CD1 4.18Å; F154-L163 HydrophobicContact CZ-CD2 3.99Å; F154-L165 HydrophobicContact CE2-CD1 4.11Å; F154-L165 HydrophobicContact CZ-CD1 3.92Å; F154-L165 HydrophobicContact CZ-CD2 4.14Å; F154-F179 HydrophobicContact CD2-CD1 4.5Å; F154-F179 HydrophobicContact CE2-CD1 4.45Å; F154-F179 HydrophobicContact CE2-CE1 4.4Å; F154-L182 HydrophobicContact CB-CD1 3.85Å; F154-L182 HydrophobicContact CB-CD2 3.76Å; F154-L182 HydrophobicContact CB-CG 3.94Å; F154-L182 HydrophobicContact CD2-CD1 3.97Å; F154-L182 HydrophobicContact CG-CD1 4.15Å
155	N	91.3	Very high	94.7	Very high	56 Å²	56	45.1 Å²	45.1	30%	0.299	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.3	-176.3	179.6	-37	0	0	0	112.5	Y152 I157 P158	Y152-N155 HydrophobicContact CD1-CB 4.38Å; Y152-N155 WeakPolarHBondContact CD1-ND2 3.41Å; Y152-N155 WeakPolarHBondContact O-CB 3.43Å; Y152-N155 PolarHBondContact O-N 3.01Å; Y152-N155 VanDerWaalsContact O-N 3.07Å; N155-I157 PolarHBondContact O-N 3.48Å; N155-P158 WeakPolarHBondContact O-CD 3.47Å
156	R	88.4	Confident	94.8	Very high	162 Å²	162	43.7 Å²	43.7	61%	0.611	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-7.4	177.3	-58.5	-54.1	-169.6	-146.4	5.3	115.4	V131 F154 P158	V131-R156 HydrophobicContact CG2-CG 4.44Å; F154-R156 PolarHBondContact O-N 3.14Å; R156-P158 VanDerWaalsContact C-CD 3.49Å
157	I	91.7	Very high	94.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.219	C	C	.	.			trans	-128.6	60.4	178.6	50.6	173.4	0	0	0	112.8	F130 L133 L136 L139 F154 N155 S159 L160	F130-I157 HydrophobicContact CB-CD1 4.39Å; F130-I157 HydrophobicContact CB-CG2 3.86Å; F130-I157 HydrophobicContact CD2-CD1 4.48Å; F130-I157 HydrophobicContact CG-CD1 4.37Å; F130-I157 WeakPolarHBondContact O-CG2 3.46Å; L133-I157 HydrophobicContact CB-CG2 3.99Å; L136-I157 HydrophobicContact CD2-CD1 4.07Å; L136-I157 HydrophobicContact CD2-CG2 4.4Å; L139-I157 HydrophobicContact CD2-CD1 3.83Å; F154-I157 HydrophobicContact CB-CG1 4.22Å; F154-I157 HydrophobicContact CD1-CD1 4.36Å; F154-I157 WeakPolarHBondContact O-CG1 3.22Å; F154-I157 PolarHBondContact O-N 3.32Å; N155-I157 PolarHBondContact O-N 3.48Å; I157-S159 PolarHBondContact O-N 3.32Å; I157-L160 HydrophobicContact CD1-CD1 4.41Å; I157-L160 HydrophobicContact CD1-CD2 4.17Å; I157-L160 WeakPolarHBondContact O-CB 3.34Å; I157-L160 PolarHBondContact O-N 3.18Å; I157-L160 VanDerWaalsContact O-N 3.13Å
158	P	92.3	Very high	95	Very high	62 Å²	62	41.8 Å²	41.8	40%	0.403	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-2	-177.9	33.3	-37.4	0	0	0	113.9	N155 R156 L160 G181 N184	N155-P158 WeakPolarHBondContact O-CD 3.47Å; R156-P158 VanDerWaalsContact C-CD 3.49Å; P158-L160 VanDerWaalsContact C-N 3.31Å; P158-G181 WeakPolarHBondContact CB-O 3.32Å; P158-N184 PolarHBondContact O-ND2 2.9Å
159	S	94.3	Very high	95	Very high	28 Å²	28	45.1 Å²	45.1	20%	0.196	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.2	171.7	55.6	0	0	0	0	113.8	S134 L136 I157	S134-S159 WeakPolarHBondContact O-CB 3.46Å; S134-S159 PolarHBondContact O-OG 2.89Å; L136-S159 CarbonylContact O-C 3.4Å; L136-S159 VanDerWaalsContact O-C 3.25Å; L136-S159 WeakPolarHBondContact O-CB 3.48Å; L136-S159 PolarHBondContact O-OG 3.39Å; I157-S159 PolarHBondContact O-N 3.32Å
160	L	96.4	Very high	94.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.236	C	C	.	.			trans	-63.4	140.3	-172.2	-160.3	72.8	0	0	0	111.8	L136 L139 I157 P158 L163 L182 N184 L185	L136-L160 HydrophobicContact CD2-CD1 4.18Å; L136-L160 HydrophobicContact CG-CD1 4.12Å; L136-L160 WeakPolarHBondContact O-CA 3.34Å; L136-L160 PolarHBondContact O-N 3.42Å; L139-L160 HydrophobicContact CB-CD1 3.77Å; L139-L160 HydrophobicContact CB-CD2 4.25Å; I157-L160 HydrophobicContact CD1-CD1 4.41Å; I157-L160 HydrophobicContact CD1-CD2 4.17Å; I157-L160 WeakPolarHBondContact O-CB 3.34Å; I157-L160 PolarHBondContact O-N 3.18Å; I157-L160 VanDerWaalsContact O-N 3.13Å; P158-L160 VanDerWaalsContact C-N 3.31Å; L160-L163 HydrophobicContact CD2-CB 3.88Å; L160-L163 HydrophobicContact CD2-CD1 4.15Å; L160-L163 HydrophobicContact CD2-CD2 4.31Å; L160-L163 HydrophobicContact CD2-CG 4.34Å; L160-L182 HydrophobicContact CB-CD2 4.06Å; L160-L182 HydrophobicContact CD2-CD2 4.18Å; L160-N184 CarbonylContact O-C 3.19Å; L160-N184 VanDerWaalsContact O-C 3.23Å; L160-L185 HydrophobicContact CB-CD1 4.36Å; L160-L185 HydrophobicContact CD2-CD1 4.02Å; L160-L185 HydrophobicContact CG-CD1 4.04Å; L160-L185 WeakPolarHBondContact O-CA 3.33Å; L160-L185 PolarHBondContact O-N 2.65Å
161	R	97.9	Very high	95	Very high	121 Å²	121	50.7 Å²	50.7	46%	0.457	23%	0.225	S	C	.	.			trans	-122.8	-29.4	-178.9	-63.9	-167.4	177.4	-158.6	-3	113.4	K137 R186 Y187	K137-R161 HydrophobicContact CB-CB 4.39Å; K137-R161 HydrophobicContact CB-CG 4.41Å; K137-R161 HydrophobicContact CG-CG 4.46Å; K137-R161 CarbonylContact O-C 3.42Å; K137-R161 WeakPolarHBondContact O-CA 3.3Å; K137-R161 PolarHBondContact O-N 3.46Å; R161-R186 PolarHBondContact O-N 3.5Å; R161-Y187 PolarHBondContact O-N 2.76Å
162	R	98.6	Very high	94.9	Very high	111 Å²	111	52.5 Å²	52.5	42%	0.419	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	128	174.9	-52.1	-164.1	161.1	102	-0.3	109.9	K137 E138 L139 Y187	K137-R162 PolarHBondContact O-N 3.46Å; E138-R162 WeakPolarHBondContact CA-O 3.46Å; E138-R162 HydrophobicContact CB-CB 4.44Å; E138-R162 HydrophobicContact CG-CB 4.1Å; E138-R162 HydrophobicContact CG-CG 4.14Å; E138-R162 IonicContact OE1-CZ 2.7Å; E138-R162 IonicContact OE1-NH1 3.22Å; E138-R162 PolarHBondContact OE1-NH1 3.08Å; L139-R162 PolarHBondContact N-O 3.13Å; R162-Y187 WeakPolarHBondContact CA-O 3.43Å; R162-Y187 HydrophobicContact CB-CD1 4.1Å
163	L	98.4	Very high	94.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	115.6	176.3	178.1	54.4	0	0	0	108.6	L139 F154 L160 L165 F179 L182 L185 Y187 L188 N189	L139-L163 HydrophobicContact CB-CD1 4.27Å; L139-L163 HydrophobicContact CD2-CD1 4.18Å; L139-L163 HydrophobicContact CG-CD1 4.21Å; F154-L163 HydrophobicContact CD1-CD2 4.47Å; F154-L163 HydrophobicContact CD2-CD2 4.02Å; F154-L163 HydrophobicContact CE1-CD1 4.03Å; F154-L163 HydrophobicContact CE1-CD2 4.31Å; F154-L163 HydrophobicContact CE2-CD2 3.85Å; F154-L163 HydrophobicContact CG-CD2 4.32Å; F154-L163 HydrophobicContact CZ-CD1 4.18Å; F154-L163 HydrophobicContact CZ-CD2 3.99Å; L160-L163 HydrophobicContact CD2-CB 3.88Å; L160-L163 HydrophobicContact CD2-CD1 4.15Å; L160-L163 HydrophobicContact CD2-CD2 4.31Å; L160-L163 HydrophobicContact CD2-CG 4.34Å; L163-L165 HydrophobicContact CD1-CD1 4.13Å; L163-L165 HydrophobicContact CD1-CD2 4.43Å; L163-L165 HydrophobicContact CD1-CG 3.95Å; L163-L165 HydrophobicContact CD2-CD1 3.77Å; L163-L165 HydrophobicContact CD2-CG 4.47Å; L163-L165 HydrophobicContact CG-CD1 3.79Å; L163-L165 HydrophobicContact CG-CG 3.96Å; L163-F179 HydrophobicContact CD2-CE1 4.48Å; L163-L182 HydrophobicContact CD2-CD1 3.86Å; L163-L185 HydrophobicContact CB-CD1 3.78Å; L163-L185 HydrophobicContact CB-CD2 4.23Å; L163-Y187 PolarHBondContact N-O 2.88Å; L163-L188 HydrophobicContact CB-CD1 4.14Å; L163-L188 HydrophobicContact CD2-CD1 4.06Å; L163-L188 HydrophobicContact CG-CD1 4.06Å; L163-L188 WeakPolarHBondContact O-CA 3.36Å; L163-N189 PolarHBondContact O-N 2.87Å
164	D	98.4	Very high	95.1	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	110.1	174.9	-177.3	10	0	0	0	110.7	L139 W140 L141 R142 G166 N189	L139-D164 PolarHBondContact O-N 2.89Å; W140-D164 HydrophobicContact CD2-CB 4.16Å; W140-D164 HydrophobicContact CE3-CB 3.35Å; W140-D164 HydrophobicContact CZ3-CB 3.82Å; L141-D164 WeakPolarHBondContact CA-O 3.33Å; L141-D164 PolarHBondContact N-O 2.87Å; R142-D164 WeakPolarHBondContact CB-OD2 3.32Å; R142-D164 WeakPolarHBondContact CD-OD2 3.37Å; R142-D164 WeakPolarHBondContact CG-OD2 3.34Å; R142-D164 PolarHBondContact N-O 3.39Å; D164-G166 PolarHBondContact OD1-N 3.46Å; D164-N189 HydrophobicContact CB-CB 4.44Å; D164-N189 WeakPolarHBondContact OD1-CB 3.48Å; D164-N189 PolarHBondContact OD1-ND2 3.01Å
165	L	97.3	Very high	95.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.246	C	C	.	.			trans	-118.6	28.4	177	-69.7	164.5	0	0	0	110.4	L141 I149 F154 L163 L168 F179 L188 N189 L190 C193	L141-L165 HydrophobicContact CB-CD2 3.97Å; L141-L165 HydrophobicContact CD1-CD2 3.96Å; I149-L165 HydrophobicContact CD1-CD1 4.05Å; F154-L165 HydrophobicContact CE2-CD1 4.11Å; F154-L165 HydrophobicContact CZ-CD1 3.92Å; F154-L165 HydrophobicContact CZ-CD2 4.14Å; L163-L165 HydrophobicContact CD1-CD1 4.13Å; L163-L165 HydrophobicContact CD1-CD2 4.43Å; L163-L165 HydrophobicContact CD1-CG 3.95Å; L163-L165 HydrophobicContact CD2-CD1 3.77Å; L163-L165 HydrophobicContact CD2-CG 4.47Å; L163-L165 HydrophobicContact CG-CD1 3.79Å; L163-L165 HydrophobicContact CG-CG 3.96Å; L165-L168 HydrophobicContact CB-CD1 3.95Å; L165-L168 HydrophobicContact CD2-CD1 3.99Å; L165-L168 VanDerWaalsContact O-CD1 3.32Å; L165-L168 WeakPolarHBondContact O-CD1 3.36Å; L165-L168 VanDerWaalsContact O-CG 3.25Å; L165-L168 WeakPolarHBondContact O-CG 3.43Å; L165-F179 HydrophobicContact CD1-CE1 3.99Å; L165-L188 HydrophobicContact CD1-CD1 4.44Å; L165-N189 CarbonylContact C-O 3.25Å; L165-N189 WeakPolarHBondContact CA-O 3.41Å; L165-N189 WeakPolarHBondContact CB-O 3.44Å; L165-N189 PolarHBondContact N-O 3.29Å; L165-L190 HydrophobicContact CB-CD2 3.86Å; L165-L190 HydrophobicContact CD1-CD2 4.2Å; L165-C193 PolarHBondContact O-SG 2.95Å
166	G	96.7	Very high	95.4	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.01	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	163.1	179.2	0	0	0	0	0	114.7	R142 N143 D164 L168 A191	R142-G166 CarbonylContact C-O 3.56Å; R142-G166 WeakPolarHBondContact CA-O 3.34Å; R142-G166 VanDerWaalsContact CB-O 3.24Å; R142-G166 WeakPolarHBondContact CB-O 3.29Å; N143-G166 PolarHBondContact N-O 2.97Å; D164-G166 PolarHBondContact OD1-N 3.46Å; G166-L168 PolarHBondContact O-N 2.86Å; G166-L168 VanDerWaalsContact O-N 3.15Å; G166-A191 CarbonylContact C-O 3.58Å; G166-A191 VanDerWaalsContact CA-O 3.25Å; G166-A191 WeakPolarHBondContact CA-O 3.19Å
167	E	97	Very high	95.7	Very high	43 Å²	43	50.2 Å²	50.2	20%	0.201	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	24.4	176.1	-72.5	-171.8	-109.4	0	0	115.8	R142 N143 K169 A191 M192	R142-E167 IonicContact CZ-OE1 3.72Å; R142-E167 IonicContact NH1-OE1 2.92Å; R142-E167 PolarHBondContact NH1-OE1 3.23Å; R142-E167 IonicContact NH2-OE1 3.73Å; R142-E167 PolarHBondContact NH2-OE1 2.92Å; N143-E167 HydrophobicContact CB-CB 3.86Å; E167-K169 WeakPolarHBondContact O-CG 3.48Å; E167-K169 PolarHBondContact O-N 3.37Å; E167-K169 WeakPolarHBondContact OE2-CE 3.48Å; E167-K169 IonicContact OE2-NZ 3.5Å; E167-K169 PolarHBondContact OE2-NZ 3.37Å; E167-A191 PolarHBondContact N-O 3.36Å; E167-M192 WeakPolarHBondContact CA-O 3.04Å; E167-M192 HydrophobicContact CG-CB 3.84Å; E167-M192 HydrophobicContact CG-CG 4.38Å; E167-M192 HydrophobicContact CG-SD 3.86Å
168	L	96.3	Very high	96	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.238	C	C	.	.			trans	-75.8	69.7	175.9	-58	179.8	0	0	0	111	N144 I146 L165 G166 R170 L171	N144-L168 HydrophobicContact CB-CD2 4.15Å; N144-L168 WeakPolarHBondContact O-CD2 3.45Å; I146-L168 HydrophobicContact CB-CD1 4.29Å; I146-L168 HydrophobicContact CB-CD2 4.13Å; I146-L168 HydrophobicContact CD1-CD1 4.27Å; I146-L168 HydrophobicContact CD1-CD2 3.94Å; I146-L168 HydrophobicContact CG1-CD2 4.18Å; L165-L168 HydrophobicContact CB-CD1 3.95Å; L165-L168 HydrophobicContact CD2-CD1 3.99Å; L165-L168 VanDerWaalsContact O-CD1 3.32Å; L165-L168 WeakPolarHBondContact O-CD1 3.36Å; L165-L168 VanDerWaalsContact O-CG 3.25Å; L165-L168 WeakPolarHBondContact O-CG 3.43Å; G166-L168 PolarHBondContact O-N 2.86Å; G166-L168 VanDerWaalsContact O-N 3.15Å; L168-R170 PolarHBondContact O-N 3.01Å; L168-L171 HydrophobicContact CB-CB 3.99Å; L168-L171 HydrophobicContact CB-CD2 4.42Å; L168-L171 HydrophobicContact CD1-CD2 4.36Å; L168-L171 WeakPolarHBondContact O-CB 3.18Å; L168-L171 PolarHBondContact O-N 3.41Å
169	K	94.3	Very high	96.2	Very high	108 Å²	108	47.3 Å²	47.3	47%	0.47	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-6.7	-172.4	-66.9	144.9	-169.8	159.6	0	115.5	N143 E167 N194	N143-K169 PolarHBondContact OD1-NZ 3.41Å; E167-K169 WeakPolarHBondContact O-CG 3.48Å; E167-K169 PolarHBondContact O-N 3.37Å; E167-K169 WeakPolarHBondContact OE2-CE 3.48Å; E167-K169 IonicContact OE2-NZ 3.5Å; E167-K169 PolarHBondContact OE2-NZ 3.37Å; K169-N194 PolarHBondContact O-ND2 2.85Å
170	R	94.8	Very high	96.2	Very high	147 Å²	147	49.6 Å²	49.6	56%	0.555	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-0.1	174.4	-71.5	-164	178.4	-166.5	-2.4	114	P145 I146 E147 L168 S172	P145-R170 HydrophobicContact CB-CG 4.49Å; I146-R170 CarbonylContact O-C 3.15Å; E147-R170 HydrophobicContact CG-CB 4.23Å; E147-R170 IonicContact OE1-NH1 3.16Å; E147-R170 PolarHBondContact OE1-NH1 3.29Å; E147-R170 VanDerWaalsContact OE1-NH1 3.16Å; L168-R170 PolarHBondContact O-N 3.01Å; R170-S172 PolarHBondContact O-N 2.91Å
171	L	96.1	Very high	96	Very high	19 Å²	19	50.6 Å²	50.6	10%	0.099	24%	0.237	C	C	.	.			trans	-63.6	120.5	-175.6	-176.3	54.7	0	0	0	110.1	I146 I149 L168 Y173 I174 C193 L195	I146-L171 WeakPolarHBondContact O-CA 3.27Å; I146-L171 PolarHBondContact O-N 3.24Å; I149-L171 HydrophobicContact CD1-CD2 4.18Å; I149-L171 HydrophobicContact CG1-CD1 3.94Å; I149-L171 HydrophobicContact CG1-CD2 4.46Å; L168-L171 HydrophobicContact CB-CB 3.99Å; L168-L171 HydrophobicContact CB-CD2 4.42Å; L168-L171 HydrophobicContact CD1-CD2 4.36Å; L168-L171 WeakPolarHBondContact O-CB 3.18Å; L168-L171 PolarHBondContact O-N 3.41Å; L171-Y173 WeakPolarHBondContact CD1-O 3.42Å; L171-I174 HydrophobicContact CD1-CG1 4.33Å; L171-I174 HydrophobicContact CD2-CD1 3.96Å; L171-I174 HydrophobicContact CD2-CG1 3.97Å; L171-I174 HydrophobicContact CG-CG1 4.35Å; L171-C193 HydrophobicContact CD2-CB 4.26Å; L171-L195 HydrophobicContact CD2-CD2 4.19Å
172	S	93.3	Very high	95.9	Very high	99 Å²	99	44.9 Å²	44.9	69%	0.692	22%	0.216	S	C	*	.			trans	-113.3	-23	-175.1	67.5	0	0	0	0	113.3	E147 R170	E147-S172 PolarHBondContact O-N 2.82Å; E147-S172 PolarHBondContact O-OG 2.72Å; R170-S172 PolarHBondContact O-N 2.91Å
173	Y	93.9	Very high	95.7	Very high	130 Å²	130	42 Å²	42	51%	0.51	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	133.8	-175	177.1	-107.8	0	0	0	111.9	S148 I149 L171 S175	S148-Y173 CarbonylContact C-O 3.24Å; S148-Y173 VanDerWaalsContact CA-O 3.25Å; S148-Y173 WeakPolarHBondContact CA-O 3.33Å; I149-Y173 PolarHBondContact N-O 3.32Å; L171-Y173 WeakPolarHBondContact CD1-O 3.42Å; Y173-S175 WeakPolarHBondContact OH-CA 3.23Å
174	I	96.8	Very high	95.6	Very high	25 Å²	25	44.6 Å²	44.6	13%	0.128	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132	165.3	-57.6	179.8	0	0	0	106.7	I149 L171 A178 F179 L195 P199	I149-I174 HydrophobicContact CB-CG1 4.43Å; I149-I174 HydrophobicContact CB-CG2 4.31Å; I149-I174 HydrophobicContact CD1-CD1 4.26Å; I149-I174 HydrophobicContact CD1-CG1 4.1Å; I149-I174 HydrophobicContact CG1-CG1 4.3Å; L171-I174 HydrophobicContact CD1-CG1 4.33Å; L171-I174 HydrophobicContact CD2-CD1 3.96Å; L171-I174 HydrophobicContact CD2-CG1 3.97Å; L171-I174 HydrophobicContact CG-CG1 4.35Å; I174-A178 HydrophobicContact CG2-CB 3.6Å; I174-F179 HydrophobicContact CG2-CE2 4.06Å; I174-F179 HydrophobicContact CG2-CZ 4.45Å; I174-L195 HydrophobicContact CD1-CD1 4.4Å; I174-L195 HydrophobicContact CD1-CD2 3.79Å; I174-P199 HydrophobicContact CB-CB 4.27Å; I174-P199 HydrophobicContact CD1-CB 4.1Å; I174-P199 HydrophobicContact CD1-CG 3.99Å; I174-P199 HydrophobicContact CG2-CB 3.83Å
175	S	96.3	Very high	95.6	Very high	10 Å²	10	44.2 Å²	44.2	7%	0.07	22%	0.224	C	C	.	.			trans	-77	146	174.6	-170.7	0	0	0	0	112.1	I149 S151 Y173 G177 A178	I149-S175 PolarHBondContact O-N 3.43Å; S151-S175 PolarHBondContact OG-OG 2.03Å; Y173-S175 WeakPolarHBondContact OH-CA 3.23Å; S175-G177 PolarHBondContact O-N 3.49Å; S175-G177 VanDerWaalsContact O-N 3.08Å; S175-A178 WeakPolarHBondContact O-CB 3.37Å; S175-A178 PolarHBondContact O-N 3.32Å
176	E	93.9	Very high	95.6	Very high	128 Å²	128	50.2 Å²	50.2	60%	0.598	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-29	169.1	-69.6	-58.7	103.2	0	0	113.6	N200	E176-N200 PolarHBondContact O-ND2 2.92Å
177	G	95.6	Very high	95.7	Very high	15 Å²	15	52 Å²	52	16%	0.155	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	13.1	175.2	0	0	0	0	0	114.6	Y152 S175 F179 E180	Y152-G177 PolarHBondContact N-O 2.65Å; S175-G177 PolarHBondContact O-N 3.49Å; S175-G177 VanDerWaalsContact O-N 3.08Å; G177-F179 PolarHBondContact O-N 3.49Å; G177-E180 PolarHBondContact O-N 2.88Å
178	A	96.7	Very high	95.8	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-44.1	-170.8	0	0	0	0	0	113.9	I149 P150 I174 S175	I149-A178 HydrophobicContact CB-CB 4.31Å; I149-A178 HydrophobicContact CG2-CB 3.61Å; P150-A178 WeakPolarHBondContact O-CA 3.41Å; I174-A178 HydrophobicContact CG2-CB 3.6Å; S175-A178 WeakPolarHBondContact O-CB 3.37Å; S175-A178 PolarHBondContact O-N 3.32Å
179	F	96.8	Very high	95.9	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.009	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	12	-174.4	-57.2	-67.5	0	0	0	113.5	I149 F154 L163 L165 I174 G177 L182 L188 L190 P199 L201 L204	I149-F179 HydrophobicContact CD1-CZ 4.43Å; F154-F179 HydrophobicContact CD2-CD1 4.5Å; F154-F179 HydrophobicContact CE2-CD1 4.45Å; F154-F179 HydrophobicContact CE2-CE1 4.4Å; L163-F179 HydrophobicContact CD2-CE1 4.48Å; L165-F179 HydrophobicContact CD1-CE1 3.99Å; I174-F179 HydrophobicContact CG2-CE2 4.06Å; I174-F179 HydrophobicContact CG2-CZ 4.45Å; G177-F179 PolarHBondContact O-N 3.49Å; F179-L182 HydrophobicContact CB-CD1 4.36Å; F179-L182 HydrophobicContact CD1-CD1 4.19Å; F179-L182 WeakPolarHBondContact O-CB 3.38Å; F179-L182 PolarHBondContact O-N 3.24Å; F179-L188 HydrophobicContact CE1-CD1 4.21Å; F179-L188 HydrophobicContact CE1-CD2 4.4Å; F179-L188 HydrophobicContact CZ-CD2 4.46Å; F179-L190 HydrophobicContact CE2-CD1 4.43Å; F179-L190 HydrophobicContact CZ-CD1 4Å; F179-L190 HydrophobicContact CZ-CD2 4.27Å; F179-P199 HydrophobicContact CE2-CB 4.36Å; F179-P199 HydrophobicContact CE2-CG 4.1Å; F179-L201 HydrophobicContact CD2-CD2 4.1Å; F179-L201 HydrophobicContact CE2-CD2 4.08Å; F179-L204 HydrophobicContact CB-CD1 4.37Å; F179-L204 HydrophobicContact CB-CD2 4.05Å; F179-L204 HydrophobicContact CB-CG 4.27Å; F179-L204 HydrophobicContact CG-CD1 4.45Å
180	E	95.6	Very high	96.1	Very high	76 Å²	76	45.4 Å²	45.4	36%	0.355	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	142.9	-178	-93.8	-65.9	-179.6	0	0	113.8	Y152 G177 L182 P203	Y152-E180 HydrophobicContact CD1-CB 3.39Å; Y152-E180 HydrophobicContact CD1-CG 4.24Å; Y152-E180 HydrophobicContact CE1-CB 3.54Å; Y152-E180 HydrophobicContact CE1-CG 3.88Å; Y152-E180 HydrophobicContact CG-CB 4.47Å; G177-E180 PolarHBondContact O-N 2.88Å; E180-L182 VanDerWaalsContact C-N 3.31Å; E180-P203 HydrophobicContact CG-CG 4.09Å
181	G	92.4	Very high	96.2	Very high	21 Å²	21	38.8 Å²	38.8	22%	0.216	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-10.1	-172.3	0	0	0	0	0	115.8	P158 S183	P158-G181 WeakPolarHBondContact CB-O 3.32Å; G181-S183 PolarHBondContact O-N 3.45Å
182	L	95.6	Very high	96.3	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	22%	0.22	C	C	.	.			trans	-80	38.1	-178.1	-68.4	-179.2	0	0	0	114.6	F154 L160 L163 F179 E180 N184 L185 L204	F154-L182 HydrophobicContact CB-CD1 3.85Å; F154-L182 HydrophobicContact CB-CD2 3.76Å; F154-L182 HydrophobicContact CB-CG 3.94Å; F154-L182 HydrophobicContact CD2-CD1 3.97Å; F154-L182 HydrophobicContact CG-CD1 4.15Å; L160-L182 HydrophobicContact CB-CD2 4.06Å; L160-L182 HydrophobicContact CD2-CD2 4.18Å; L163-L182 HydrophobicContact CD2-CD1 3.86Å; F179-L182 HydrophobicContact CB-CD1 4.36Å; F179-L182 HydrophobicContact CD1-CD1 4.19Å; F179-L182 WeakPolarHBondContact O-CB 3.38Å; F179-L182 PolarHBondContact O-N 3.24Å; E180-L182 VanDerWaalsContact C-N 3.31Å; L182-N184 PolarHBondContact O-N 3.04Å; L182-L185 HydrophobicContact CB-CB 4.26Å; L182-L185 HydrophobicContact CD1-CD2 4.35Å; L182-L185 WeakPolarHBondContact O-CB 3.35Å; L182-L185 PolarHBondContact O-N 2.78Å; L182-L204 HydrophobicContact CB-CD2 3.6Å; L182-L204 HydrophobicContact CD1-CD2 4.44Å
183	S	94.1	Very high	96.4	Very high	49 Å²	49	37.8 Å²	37.8	34%	0.343	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	0.2	-175	63.5	0	0	0	0	116.2	G181 K206	G181-S183 PolarHBondContact O-N 3.45Å; S183-K206 WeakPolarHBondContact O-CD 3.09Å; S183-K206 WeakPolarHBondContact O-CE 3.03Å; S183-K206 WeakPolarHBondContact O-CG 3Å; S183-K206 PolarHBondContact O-NZ 3.14Å
184	N	96.1	Very high	96.5	Very high	55 Å²	55	35 Å²	35	29%	0.294	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	2.6	174.9	-63.3	-61.8	0	0	0	114	P158 L160 L182 K206	P158-N184 PolarHBondContact O-ND2 2.9Å; L160-N184 CarbonylContact O-C 3.19Å; L160-N184 VanDerWaalsContact O-C 3.23Å; L182-N184 PolarHBondContact O-N 3.04Å; N184-K206 PolarHBondContact OD1-NZ 2.98Å
185	L	97.9	Very high	96.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.			trans	-65.4	139.1	177.2	-158.7	75.8	0	0	0	110.4	L160 L163 L182 L188 L204 K206 L207	L160-L185 HydrophobicContact CB-CD1 4.36Å; L160-L185 HydrophobicContact CD2-CD1 4.02Å; L160-L185 HydrophobicContact CG-CD1 4.04Å; L160-L185 WeakPolarHBondContact O-CA 3.33Å; L160-L185 PolarHBondContact O-N 2.65Å; L163-L185 HydrophobicContact CB-CD1 3.78Å; L163-L185 HydrophobicContact CB-CD2 4.23Å; L182-L185 HydrophobicContact CB-CB 4.26Å; L182-L185 HydrophobicContact CD1-CD2 4.35Å; L182-L185 WeakPolarHBondContact O-CB 3.35Å; L182-L185 PolarHBondContact O-N 2.78Å; L185-L188 HydrophobicContact CD2-CB 3.98Å; L185-L188 HydrophobicContact CD2-CD1 4.26Å; L185-L204 HydrophobicContact CB-CD2 4.1Å; L185-L204 HydrophobicContact CD2-CD1 4.29Å; L185-L204 HydrophobicContact CD2-CD2 3.88Å; L185-K206 CarbonylContact O-C 3.51Å; L185-K206 VanDerWaalsContact O-O 3.04Å; L185-L207 HydrophobicContact CD2-CD1 4.07Å; L185-L207 HydrophobicContact CG-CD1 4.28Å; L185-L207 PolarHBondContact O-N 3.48Å
186	R	98.1	Very high	96.3	Very high	125 Å²	125	44.1 Å²	44.1	47%	0.472	21%	0.213	S	C	.	.			trans	-119.4	-38.7	177	-67.8	-167.4	178.4	-157.1	-3	112.6	R161 L207 D208 E209	R161-R186 PolarHBondContact O-N 3.5Å; R186-L207 WeakPolarHBondContact O-CD1 3.5Å; R186-D208 HydrophobicContact CB-CB 3.91Å; R186-D208 HydrophobicContact CG-CB 4.42Å; R186-D208 WeakPolarHBondContact O-CA 3.22Å; R186-D208 WeakPolarHBondContact O-CB 3.45Å; R186-D208 PolarHBondContact O-N 3.24Å; R186-E209 PolarHBondContact O-N 2.88Å
187	Y	98.6	Very high	96.3	Very high	39 Å²	39	45.3 Å²	45.3	15%	0.153	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.6	177.9	175.3	-89.9	0	0	0	110.2	R161 R162 L163 N189 E209 W235	R161-Y187 PolarHBondContact O-N 2.76Å; R162-Y187 WeakPolarHBondContact CA-O 3.43Å; R162-Y187 HydrophobicContact CB-CD1 4.1Å; L163-Y187 PolarHBondContact N-O 2.88Å; Y187-N189 HydrophobicContact CE1-CB 3.81Å; Y187-E209 WeakPolarHBondContact CA-O 3.48Å; Y187-E209 HydrophobicContact CD2-CB 3.87Å; Y187-E209 WeakPolarHBondContact CD2-OE2 3.41Å; Y187-W235 HydrophobicContact CE2-CZ3 4.34Å
188	L	98.6	Very high	96.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.4	169.7	179.8	63	0	0	0	109.9	L163 L165 F179 L185 L190 L201 L204 L207 E209 L210 D211	L163-L188 HydrophobicContact CB-CD1 4.14Å; L163-L188 HydrophobicContact CD2-CD1 4.06Å; L163-L188 HydrophobicContact CG-CD1 4.06Å; L163-L188 WeakPolarHBondContact O-CA 3.36Å; L165-L188 HydrophobicContact CD1-CD1 4.44Å; F179-L188 HydrophobicContact CE1-CD1 4.21Å; F179-L188 HydrophobicContact CE1-CD2 4.4Å; F179-L188 HydrophobicContact CZ-CD2 4.46Å; L185-L188 HydrophobicContact CD2-CB 3.98Å; L185-L188 HydrophobicContact CD2-CD1 4.26Å; L188-L190 HydrophobicContact CD1-CG 4.28Å; L188-L190 HydrophobicContact CD2-CD1 3.82Å; L188-L190 HydrophobicContact CD2-CG 4.29Å; L188-L190 HydrophobicContact CG-CD1 4.21Å; L188-L190 HydrophobicContact CG-CG 4.12Å; L188-L201 HydrophobicContact CD2-CD2 3.85Å; L188-L204 HydrophobicContact CD2-CD1 3.66Å; L188-L207 HydrophobicContact CB-CD1 3.85Å; L188-L207 HydrophobicContact CB-CD2 4.45Å; L188-E209 PolarHBondContact N-O 3.28Å; L188-E209 VanDerWaalsContact N-O 3.1Å; L188-L210 HydrophobicContact CB-CD1 4.19Å; L188-L210 HydrophobicContact CD2-CD1 4.15Å; L188-L210 HydrophobicContact CG-CD1 4.27Å; L188-D211 PolarHBondContact O-N 2.92Å
189	N	98.6	Very high	96.2	Very high	13 Å²	13	46.4 Å²	46.4	7%	0.07	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.9	169.3	-177.9	17.5	0	0	0	110.7	L163 D164 L165 Y187 A191 D211	L163-N189 PolarHBondContact O-N 2.87Å; D164-N189 HydrophobicContact CB-CB 4.44Å; D164-N189 WeakPolarHBondContact OD1-CB 3.48Å; D164-N189 PolarHBondContact OD1-ND2 3.01Å; L165-N189 CarbonylContact C-O 3.25Å; L165-N189 WeakPolarHBondContact CA-O 3.41Å; L165-N189 WeakPolarHBondContact CB-O 3.44Å; L165-N189 PolarHBondContact N-O 3.29Å; Y187-N189 HydrophobicContact CE1-CB 3.81Å; N189-A191 WeakPolarHBondContact OD1-CB 3.38Å; N189-A191 PolarHBondContact OD1-N 2.83Å; N189-D211 HydrophobicContact CB-CB 4.49Å
190	L	97.8	Very high	96.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.232	C	C	.	.			trans	-127.8	23.4	172.4	-71.6	170.5	0	0	0	110.9	L165 F179 L188 L195 P199 D211 L212 N215	L165-L190 HydrophobicContact CB-CD2 3.86Å; L165-L190 HydrophobicContact CD1-CD2 4.2Å; F179-L190 HydrophobicContact CE2-CD1 4.43Å; F179-L190 HydrophobicContact CZ-CD1 4Å; F179-L190 HydrophobicContact CZ-CD2 4.27Å; L188-L190 HydrophobicContact CD1-CG 4.28Å; L188-L190 HydrophobicContact CD2-CD1 3.82Å; L188-L190 HydrophobicContact CD2-CG 4.29Å; L188-L190 HydrophobicContact CG-CD1 4.21Å; L188-L190 HydrophobicContact CG-CG 4.12Å; L190-L195 HydrophobicContact CB-CD1 4.13Å; L190-P199 HydrophobicContact CD1-CG 4.07Å; L190-D211 CarbonylContact C-O 3.56Å; L190-D211 PolarHBondContact N-O 3.28Å; L190-L212 HydrophobicContact CB-CD2 4.01Å; L190-L212 HydrophobicContact CD1-CD2 4.39Å; L190-N215 PolarHBondContact O-ND2 3.06Å
191	A	98.1	Very high	96.1	Very high	8 Å²	8	44.9 Å²	44.9	7%	0.066	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	150.1	178.9	0	0	0	0	0	112.3	G166 E167 N189 C193 D211 S213	G166-A191 CarbonylContact C-O 3.58Å; G166-A191 VanDerWaalsContact CA-O 3.25Å; G166-A191 WeakPolarHBondContact CA-O 3.19Å; E167-A191 PolarHBondContact N-O 3.36Å; N189-A191 WeakPolarHBondContact OD1-CB 3.38Å; N189-A191 PolarHBondContact OD1-N 2.83Å; A191-C193 PolarHBondContact O-N 3.22Å; A191-C193 PolarHBondContact O-SG 3.35Å; A191-D211 PolarHBondContact N-O 3.37Å; A191-S213 CarbonylContact C-O 3.54Å; A191-S213 WeakPolarHBondContact CA-O 3.41Å; A191-S213 VanDerWaalsContact CB-O 3.25Å; A191-S213 WeakPolarHBondContact CB-O 3.37Å
192	M	97.1	Very high	96.2	Very high	97 Å²	97	46.7 Å²	46.7	48%	0.478	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	35.2	175.9	-54.1	-175	-171.2	0	0	114.2	E167 S213 G214	E167-M192 WeakPolarHBondContact CA-O 3.04Å; E167-M192 HydrophobicContact CG-CB 3.84Å; E167-M192 HydrophobicContact CG-CG 4.38Å; E167-M192 HydrophobicContact CG-SD 3.86Å; M192-S213 PolarHBondContact N-O 2.98Å; M192-G214 WeakPolarHBondContact CA-O 3.37Å
193	C	96.8	Very high	96.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	-104.2	11.8	180	-67.7	0	0	0	0	113.1	L165 L171 A191 L195 N215	L165-C193 PolarHBondContact O-SG 2.95Å; L171-C193 HydrophobicContact CD2-CB 4.26Å; A191-C193 PolarHBondContact O-N 3.22Å; A191-C193 PolarHBondContact O-SG 3.35Å; C193-L195 HydrophobicContact CB-CD1 4.34Å; C193-L195 HydrophobicContact CB-CD2 4.17Å; C193-L195 HydrophobicContact CB-CG 3.88Å; C193-L195 PolarHBondContact O-N 2.97Å; C193-L195 VanDerWaalsContact O-N 3.14Å; C193-N215 WeakPolarHBondContact CA-OD1 3.24Å; C193-N215 PolarHBondContact N-OD1 3.27Å
194	N	94.8	Very high	96.3	Very high	71 Å²	71	45.1 Å²	45.1	38%	0.38	21%	0.211	S	C	.	.			trans	56.6	23.7	179.7	-52.5	-26.6	0	0	0	114.4	K169 N215	K169-N194 PolarHBondContact O-ND2 2.85Å; N194-N215 PolarHBondContact N-OD1 2.84Å
195	L	95	Very high	96.2	Very high	18 Å²	18	45.7 Å²	45.7	9%	0.094	22%	0.217	C	C	.	.			trans	-65.5	132.9	-175.3	-57	178.9	0	0	0	111.4	L171 I174 L190 C193 L212 N215 H216 L217	L171-L195 HydrophobicContact CD2-CD2 4.19Å; I174-L195 HydrophobicContact CD1-CD1 4.4Å; I174-L195 HydrophobicContact CD1-CD2 3.79Å; L190-L195 HydrophobicContact CB-CD1 4.13Å; C193-L195 HydrophobicContact CB-CD1 4.34Å; C193-L195 HydrophobicContact CB-CD2 4.17Å; C193-L195 HydrophobicContact CB-CG 3.88Å; C193-L195 PolarHBondContact O-N 2.97Å; C193-L195 VanDerWaalsContact O-N 3.14Å; L195-L212 HydrophobicContact CD1-CD2 4.39Å; L195-N215 HydrophobicContact CB-CB 4.17Å; L195-N215 PolarHBondContact N-OD1 2.96Å; L195-H216 CarbonylContact O-C 3.46Å; L195-H216 VanDerWaalsContact O-C 3.28Å; L195-H216 VanDerWaalsContact O-CA 3.31Å; L195-H216 WeakPolarHBondContact O-CA 3.37Å; L195-H216 PolarHBondContact O-N 3.17Å; L195-L217 HydrophobicContact CB-CD2 4.4Å
196	R	93.8	Very high	96.1	Very high	209 Å²	209	50.5 Å²	50.5	79%	0.789	24%	0.238	S	C	*	.	S	Bend	trans	-90.5	-23.6	176.7	-65.1	-178.3	179.9	-179	-0.2	113.4	H216	R196-H216 HydrophobicContact CG-CB 4.47Å
197	E	93.4	Very high	96.1	Very high	153 Å²	153	44.6 Å²	44.6	72%	0.715	22%	0.216	S	C	*	.	S	Bend	trans	-141.2	163.2	179.8	65.8	-156.8	151.2	0	0	109.5
198	I	95.3	Very high	96.1	Very high	23 Å²	23	44.4 Å²	44.4	12%	0.118	22%	0.217	C	C	.	.			trans	-87	123.9	179.1	-57.7	-177.8	0	0	0	107.3	L201 L212 L217 I220 F225	I198-L201 HydrophobicContact CG2-CD1 4.07Å; I198-L201 HydrophobicContact CG2-CG 4.44Å; I198-L212 HydrophobicContact CD1-CD1 3.85Å; I198-L212 HydrophobicContact CG1-CD1 4.14Å; I198-L212 HydrophobicContact CG2-CD1 4.15Å; I198-L217 HydrophobicContact CD1-CD1 4.21Å; I198-L217 HydrophobicContact CG1-CD1 3.93Å; I198-L217 HydrophobicContact CG1-CD2 3.94Å; I198-I220 HydrophobicContact CD1-CD1 4.13Å; I198-F225 HydrophobicContact CD1-CE1 3.67Å; I198-F225 HydrophobicContact CD1-CE2 3.97Å; I198-F225 HydrophobicContact CD1-CZ 3.31Å
199	P	95.6	Very high	96.1	Very high	15 Å²	15	46.3 Å²	46.3	10%	0.097	23%	0.226	C	C	.	.			trans	-68.5	168.3	-178.7	30.5	-36.7	0	0	0	111.3	I174 F179 L190 L201	I174-P199 HydrophobicContact CB-CB 4.27Å; I174-P199 HydrophobicContact CD1-CB 4.1Å; I174-P199 HydrophobicContact CD1-CG 3.99Å; I174-P199 HydrophobicContact CG2-CB 3.83Å; F179-P199 HydrophobicContact CE2-CB 4.36Å; F179-P199 HydrophobicContact CE2-CG 4.1Å; L190-P199 HydrophobicContact CD1-CG 4.07Å; P199-L201 HydrophobicContact CG-CD2 4.17Å; P199-L201 WeakPolarHBondContact O-CG 3.41Å; P199-L201 PolarHBondContact O-N 3Å
200	N	95.1	Very high	96.1	Very high	41 Å²	41	45.7 Å²	45.7	22%	0.219	22%	0.223	C	C	.	.			trans	-60.2	109.3	174.2	-179.6	22	0	0	0	112.5	E176 T202	E176-N200 PolarHBondContact O-ND2 2.92Å; N200-T202 PolarHBondContact ND2-OG1 3.11Å; N200-T202 WeakPolarHBondContact OD1-CB 3.32Å; N200-T202 WeakPolarHBondContact OD1-CG2 3.34Å; N200-T202 PolarHBondContact OD1-N 3.29Å; N200-T202 PolarHBondContact OD1-OG1 3.22Å
201	L	96	Very high	96.1	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.026	23%	0.231	C	C	.	.			trans	-102.4	2.2	175.7	-57.2	-177.3	0	0	0	113.2	F179 L188 I198 P199 P203 L204 L210 L228	F179-L201 HydrophobicContact CD2-CD2 4.1Å; F179-L201 HydrophobicContact CE2-CD2 4.08Å; L188-L201 HydrophobicContact CD2-CD2 3.85Å; I198-L201 HydrophobicContact CG2-CD1 4.07Å; I198-L201 HydrophobicContact CG2-CG 4.44Å; P199-L201 HydrophobicContact CG-CD2 4.17Å; P199-L201 WeakPolarHBondContact O-CG 3.41Å; P199-L201 PolarHBondContact O-N 3Å; L201-P203 VanDerWaalsContact C-N 3.33Å; L201-P203 VanDerWaalsContact O-N 3.17Å; L201-L204 HydrophobicContact CB-CD1 4.33Å; L201-L204 HydrophobicContact CD2-CD1 3.9Å; L201-L204 WeakPolarHBondContact O-CB 3.46Å; L201-L204 PolarHBondContact O-N 3.4Å; L201-L210 HydrophobicContact CD1-CD1 4.15Å; L201-L210 HydrophobicContact CD1-CD2 3.48Å; L201-L210 VanDerWaalsContact CD1-CD2 3.48Å; L201-L210 HydrophobicContact CD1-CG 4.5Å; L201-L228 HydrophobicContact CB-CD1 4.09Å; L201-L228 HydrophobicContact CB-CD2 4.16Å; L201-L228 HydrophobicContact CB-CG 4.45Å; L201-L228 HydrophobicContact CD1-CD1 3.94Å
202	T	93.9	Very high	96.1	Very high	58 Å²	58	46.8 Å²	46.8	36%	0.356	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.5	-175.3	59	0	0	0	0	115.9	N200 L204 Q226	N200-T202 PolarHBondContact ND2-OG1 3.11Å; N200-T202 WeakPolarHBondContact OD1-CB 3.32Å; N200-T202 WeakPolarHBondContact OD1-CG2 3.34Å; N200-T202 PolarHBondContact OD1-N 3.29Å; N200-T202 PolarHBondContact OD1-OG1 3.22Å; T202-L204 PolarHBondContact O-N 3.03Å; T202-Q226 HydrophobicContact CG2-CB 4.14Å; T202-Q226 HydrophobicContact CG2-CG 4.23Å; T202-Q226 WeakPolarHBondContact CG2-O 3.48Å
203	P	95.2	Very high	96.2	Very high	17 Å²	17	42.7 Å²	42.7	11%	0.11	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.7	175	-20.7	34.7	0	0	0	114.3	E180 L201 V205	E180-P203 HydrophobicContact CG-CG 4.09Å; L201-P203 VanDerWaalsContact C-N 3.33Å; L201-P203 VanDerWaalsContact O-N 3.17Å; P203-V205 PolarHBondContact O-N 2.97Å
204	L	96	Very high	96.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.219	C	C	.	.			trans	-86	49.6	-172	-56.7	179.7	0	0	0	112.3	F179 L182 L185 L188 L201 T202 K206 L207 L228	F179-L204 HydrophobicContact CB-CD1 4.37Å; F179-L204 HydrophobicContact CB-CD2 4.05Å; F179-L204 HydrophobicContact CB-CG 4.27Å; F179-L204 HydrophobicContact CG-CD1 4.45Å; L182-L204 HydrophobicContact CB-CD2 3.6Å; L182-L204 HydrophobicContact CD1-CD2 4.44Å; L185-L204 HydrophobicContact CB-CD2 4.1Å; L185-L204 HydrophobicContact CD2-CD1 4.29Å; L185-L204 HydrophobicContact CD2-CD2 3.88Å; L188-L204 HydrophobicContact CD2-CD1 3.66Å; L201-L204 HydrophobicContact CB-CD1 4.33Å; L201-L204 HydrophobicContact CD2-CD1 3.9Å; L201-L204 WeakPolarHBondContact O-CB 3.46Å; L201-L204 PolarHBondContact O-N 3.4Å; T202-L204 PolarHBondContact O-N 3.03Å; L204-K206 PolarHBondContact O-N 3.09Å; L204-L207 HydrophobicContact CB-CB 4.15Å; L204-L207 HydrophobicContact CB-CD2 4.43Å; L204-L207 HydrophobicContact CD1-CD1 4.42Å; L204-L207 HydrophobicContact CD1-CD2 4.22Å; L204-L207 VanDerWaalsContact O-CB 3.3Å; L204-L207 WeakPolarHBondContact O-CB 3.21Å; L204-L207 PolarHBondContact O-N 3.06Å; L204-L228 HydrophobicContact CB-CD2 4.25Å
205	V	94.3	Very high	96.3	Very high	68 Å²	68	40.4 Å²	40.4	41%	0.412	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-7.2	-171.6	-62.3	0	0	0	0	115.9	P203 H230	P203-V205 PolarHBondContact O-N 2.97Å; V205-H230 PolarHBondContact O-CD2 2.99Å
206	K	96.4	Very high	96.4	Very high	100 Å²	100	42.7 Å²	42.7	44%	0.435	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	15	175.3	-60.9	-177.1	-158.6	161.6	0	113.4	S183 N184 L185 L204	S183-K206 WeakPolarHBondContact O-CD 3.09Å; S183-K206 WeakPolarHBondContact O-CE 3.03Å; S183-K206 WeakPolarHBondContact O-CG 3Å; S183-K206 PolarHBondContact O-NZ 3.14Å; N184-K206 PolarHBondContact OD1-NZ 2.98Å; L185-K206 CarbonylContact O-C 3.51Å; L185-K206 VanDerWaalsContact O-O 3.04Å; L204-K206 PolarHBondContact O-N 3.09Å
207	L	98	Very high	96.5	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	17%	0.174	C	C	.	.			trans	-62.6	138.5	177.9	-155	69.4	0	0	0	110.3	L185 R186 L188 L204 L210 L228 H230 L231	L185-L207 HydrophobicContact CD2-CD1 4.07Å; L185-L207 HydrophobicContact CG-CD1 4.28Å; L185-L207 PolarHBondContact O-N 3.48Å; R186-L207 WeakPolarHBondContact O-CD1 3.5Å; L188-L207 HydrophobicContact CB-CD1 3.85Å; L188-L207 HydrophobicContact CB-CD2 4.45Å; L204-L207 HydrophobicContact CB-CB 4.15Å; L204-L207 HydrophobicContact CB-CD2 4.43Å; L204-L207 HydrophobicContact CD1-CD1 4.42Å; L204-L207 HydrophobicContact CD1-CD2 4.22Å; L204-L207 VanDerWaalsContact O-CB 3.3Å; L204-L207 WeakPolarHBondContact O-CB 3.21Å; L204-L207 PolarHBondContact O-N 3.06Å; L207-L210 HydrophobicContact CD2-CB 4.02Å; L207-L210 HydrophobicContact CD2-CD1 4.26Å; L207-L210 HydrophobicContact CD2-CD2 4.29Å; L207-L210 HydrophobicContact CD2-CG 4.42Å; L207-L228 HydrophobicContact CB-CD2 4.17Å; L207-L228 HydrophobicContact CD2-CD1 4.47Å; L207-L228 HydrophobicContact CD2-CD2 4.15Å; L207-H230 CarbonylContact O-C 3.58Å; L207-L231 HydrophobicContact CB-CD1 4.27Å; L207-L231 HydrophobicContact CD2-CD1 4.06Å; L207-L231 HydrophobicContact CG-CD1 3.96Å; L207-L231 VanDerWaalsContact O-CA 3.32Å; L207-L231 WeakPolarHBondContact O-CA 3.38Å; L207-L231 PolarHBondContact O-N 3.04Å
208	D	97.8	Very high	96.5	Very high	34 Å²	34	29 Å²	29	18%	0.182	16%	0.162	C	C	.	.			trans	-125.8	-41.3	-166.2	-165.8	4.1	0	0	0	108.7	R186 Q232 K233	R186-D208 HydrophobicContact CB-CB 3.91Å; R186-D208 HydrophobicContact CG-CB 4.42Å; R186-D208 WeakPolarHBondContact O-CA 3.22Å; R186-D208 WeakPolarHBondContact O-CB 3.45Å; R186-D208 PolarHBondContact O-N 3.24Å; D208-Q232 PolarHBondContact O-N 3.02Å; D208-Q232 VanDerWaalsContact OD1-CD 3.24Å; D208-Q232 WeakPolarHBondContact OD1-CG 3.31Å; D208-Q232 PolarHBondContact OD1-NE2 2.91Å; D208-K233 PolarHBondContact O-N 3.32Å
209	E	98.5	Very high	96.5	Very high	41 Å²	41	28.9 Å²	28.9	19%	0.192	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.9	-179.7	-58.1	-175.6	147.4	0	0	110.6	R186 Y187 L188 K233 W235	R186-E209 PolarHBondContact O-N 2.88Å; Y187-E209 WeakPolarHBondContact CA-O 3.48Å; Y187-E209 HydrophobicContact CD2-CB 3.87Å; Y187-E209 WeakPolarHBondContact CD2-OE2 3.41Å; L188-E209 PolarHBondContact N-O 3.28Å; L188-E209 VanDerWaalsContact N-O 3.1Å; E209-K233 HydrophobicContact CG-CB 4.28Å; E209-K233 HydrophobicContact CG-CD 4.06Å; E209-K233 HydrophobicContact CG-CG 4.29Å; E209-K233 WeakPolarHBondContact OE1-CE 3.43Å; E209-K233 IonicContact OE1-NZ 2.74Å; E209-K233 PolarHBondContact OE1-NZ 3.03Å; E209-W235 HydrophobicContact CB-CH2 4.02Å; E209-W235 HydrophobicContact CB-CZ3 3.91Å; E209-W235 HydrophobicContact CG-CH2 4.21Å
210	L	98.6	Very high	96.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	121.8	179.5	175.4	58.4	0	0	0	111	L188 L201 L207 L212 F225 L228 L231 K233 L234 W235	L188-L210 HydrophobicContact CB-CD1 4.19Å; L188-L210 HydrophobicContact CD2-CD1 4.15Å; L188-L210 HydrophobicContact CG-CD1 4.27Å; L201-L210 HydrophobicContact CD1-CD1 4.15Å; L201-L210 HydrophobicContact CD1-CD2 3.48Å; L201-L210 VanDerWaalsContact CD1-CD2 3.48Å; L201-L210 HydrophobicContact CD1-CG 4.5Å; L207-L210 HydrophobicContact CD2-CB 4.02Å; L207-L210 HydrophobicContact CD2-CD1 4.26Å; L207-L210 HydrophobicContact CD2-CD2 4.29Å; L207-L210 HydrophobicContact CD2-CG 4.42Å; L210-L212 HydrophobicContact CD1-CD1 4.49Å; L210-L212 HydrophobicContact CD1-CG 4.12Å; L210-L212 HydrophobicContact CD2-CD1 3.96Å; L210-L212 HydrophobicContact CD2-CG 4.45Å; L210-L212 HydrophobicContact CG-CD1 4.15Å; L210-L212 HydrophobicContact CG-CG 4.12Å; L210-F225 HydrophobicContact CD2-CD1 4.29Å; L210-F225 HydrophobicContact CD2-CE1 4.13Å; L210-L228 HydrophobicContact CD2-CD1 4.13Å; L210-L231 HydrophobicContact CB-CD1 3.75Å; L210-L231 HydrophobicContact CB-CD2 4.28Å; L210-L231 HydrophobicContact CD2-CD2 4.42Å; L210-K233 PolarHBondContact N-O 3.36Å; L210-L234 HydrophobicContact CB-CD1 4.29Å; L210-L234 HydrophobicContact CD2-CD1 3.96Å; L210-L234 HydrophobicContact CG-CD1 4.1Å; L210-W235 PolarHBondContact O-N 3.07Å
211	D	98.6	Very high	96.4	Very high	31 Å²	31	32.3 Å²	32.3	17%	0.166	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121.4	171.9	-163.5	-3.5	0	0	0	111.6	L188 N189 L190 A191 S213 W235	L188-D211 PolarHBondContact O-N 2.92Å; N189-D211 HydrophobicContact CB-CB 4.49Å; L190-D211 CarbonylContact C-O 3.56Å; L190-D211 PolarHBondContact N-O 3.28Å; A191-D211 PolarHBondContact N-O 3.37Å; D211-S213 WeakPolarHBondContact OD1-CB 3.41Å; D211-S213 PolarHBondContact OD1-N 3Å; D211-S213 PolarHBondContact OD1-OG 3.15Å; D211-W235 HydrophobicContact CB-CE3 3.91Å
212	L	98	Very high	96	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.18	C	C	.	.			trans	-124.6	16.8	176.9	-72.4	168.7	0	0	0	111.4	L190 L195 I198 L210 N215 L217 F225 L234 W235 M236 S239	L190-L212 HydrophobicContact CB-CD2 4.01Å; L190-L212 HydrophobicContact CD1-CD2 4.39Å; L195-L212 HydrophobicContact CD1-CD2 4.39Å; I198-L212 HydrophobicContact CD1-CD1 3.85Å; I198-L212 HydrophobicContact CG1-CD1 4.14Å; I198-L212 HydrophobicContact CG2-CD1 4.15Å; L210-L212 HydrophobicContact CD1-CD1 4.49Å; L210-L212 HydrophobicContact CD1-CG 4.12Å; L210-L212 HydrophobicContact CD2-CD1 3.96Å; L210-L212 HydrophobicContact CD2-CG 4.45Å; L210-L212 HydrophobicContact CG-CD1 4.15Å; L210-L212 HydrophobicContact CG-CG 4.12Å; L212-N215 PolarHBondContact O-ND2 3.36Å; L212-L217 HydrophobicContact CB-CD1 4.17Å; L212-L217 HydrophobicContact CD1-CD1 4.49Å; L212-F225 HydrophobicContact CD1-CE1 3.95Å; L212-F225 HydrophobicContact CD1-CZ 4.43Å; L212-L234 HydrophobicContact CD1-CD1 4.45Å; L212-W235 PolarHBondContact N-O 3.1Å; L212-M236 HydrophobicContact CB-CG 4.13Å; L212-S239 PolarHBondContact O-OG 2.03Å
213	S	98.4	Very high	95.6	Very high	11 Å²	11	32.3 Å²	32.3	8%	0.077	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	149.2	-176.1	-57.2	0	0	0	0	113.4	A191 M192 D211 N215 I237 S239	A191-S213 CarbonylContact C-O 3.54Å; A191-S213 WeakPolarHBondContact CA-O 3.41Å; A191-S213 VanDerWaalsContact CB-O 3.25Å; A191-S213 WeakPolarHBondContact CB-O 3.37Å; M192-S213 PolarHBondContact N-O 2.98Å; D211-S213 WeakPolarHBondContact OD1-CB 3.41Å; D211-S213 PolarHBondContact OD1-N 3Å; D211-S213 PolarHBondContact OD1-OG 3.15Å; S213-N215 VanDerWaalsContact C-N 3.31Å; S213-N215 PolarHBondContact O-N 2.81Å; S213-I237 CarbonylContact C-O 3.36Å; S213-I237 VanDerWaalsContact CA-O 3.24Å; S213-I237 WeakPolarHBondContact CA-O 3.41Å; S213-I237 VanDerWaalsContact CB-O 3.29Å; S213-I237 WeakPolarHBondContact CB-O 3.42Å; S213-I237 PolarHBondContact OG-N 3.39Å; S213-S239 WeakPolarHBondContact CA-OG 3.47Å
214	G	97.3	Very high	95.4	Very high	22 Å²	22	33.2 Å²	33.2	23%	0.227	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	26	175	0	0	0	0	0	114.7	M192 I237 S239	M192-G214 WeakPolarHBondContact CA-O 3.37Å; G214-I237 PolarHBondContact N-O 2.85Å; G214-S239 PolarHBondContact N-OG 2.93Å
215	N	97.6	Very high	95.3	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.186	C	C	.	.	S	Bend	trans	-99.1	-170.2	174.1	-76	-56.3	0	0	0	111.6	L190 C193 N194 L195 L212 S213 L217 S239	L190-N215 PolarHBondContact O-ND2 3.06Å; C193-N215 WeakPolarHBondContact CA-OD1 3.24Å; C193-N215 PolarHBondContact N-OD1 3.27Å; N194-N215 PolarHBondContact N-OD1 2.84Å; L195-N215 HydrophobicContact CB-CB 4.17Å; L195-N215 PolarHBondContact N-OD1 2.96Å; L212-N215 PolarHBondContact O-ND2 3.36Å; S213-N215 VanDerWaalsContact C-N 3.31Å; S213-N215 PolarHBondContact O-N 2.81Å; N215-L217 HydrophobicContact CB-CD1 4.45Å; N215-L217 HydrophobicContact CB-CG 4.02Å; N215-S239 CarbonylContact O-C 3.55Å; N215-S239 VanDerWaalsContact O-CA 3.27Å; N215-S239 WeakPolarHBondContact O-CA 3.22Å
216	H	96	Very high	95.1	Very high	65 Å²	65	32.8 Å²	32.8	30%	0.301	18%	0.179	S	C	.	.			trans	-115.9	42.4	-179.4	-62.1	-62.1	0	0	0	111.8	L195 R196 T218 Q240	L195-H216 CarbonylContact O-C 3.46Å; L195-H216 VanDerWaalsContact O-C 3.28Å; L195-H216 VanDerWaalsContact O-CA 3.31Å; L195-H216 WeakPolarHBondContact O-CA 3.37Å; L195-H216 PolarHBondContact O-N 3.17Å; R196-H216 HydrophobicContact CG-CB 4.47Å; H216-T218 PolarHBondContact O-N 3.01Å; H216-Q240 VanDerWaalsContact ND1-CD 3.28Å; H216-Q240 PolarHBondContact ND1-NE2 2.96Å; H216-Q240 PolarHBondContact ND1-OE1 3.13Å
217	L	95.9	Very high	94.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	17%	0.171	C	C	.	.			trans	-78.6	79.3	-176	-58	178.9	0	0	0	110.2	L195 I198 L212 N215 A219 I220 S239 I241	L195-L217 HydrophobicContact CB-CD2 4.4Å; I198-L217 HydrophobicContact CD1-CD1 4.21Å; I198-L217 HydrophobicContact CG1-CD1 3.93Å; I198-L217 HydrophobicContact CG1-CD2 3.94Å; L212-L217 HydrophobicContact CB-CD1 4.17Å; L212-L217 HydrophobicContact CD1-CD1 4.49Å; N215-L217 HydrophobicContact CB-CD1 4.45Å; N215-L217 HydrophobicContact CB-CG 4.02Å; L217-A219 VanDerWaalsContact C-N 3.29Å; L217-A219 PolarHBondContact O-N 3.15Å; L217-I220 HydrophobicContact CB-CD1 4.18Å; L217-I220 HydrophobicContact CD1-CD1 4.46Å; L217-S239 PolarHBondContact N-O 2.98Å; L217-I241 HydrophobicContact CB-CG1 4.37Å; L217-I241 VanDerWaalsContact O-CA 3.24Å; L217-I241 WeakPolarHBondContact O-CA 3.49Å; L217-I241 VanDerWaalsContact O-CG1 3.22Å; L217-I241 WeakPolarHBondContact O-CG1 3.42Å
218	T	94.2	Very high	94.4	Very high	73 Å²	73	29.2 Å²	29.2	45%	0.448	17%	0.171	S	C	.	.			trans	-62.3	-32.4	-172.1	55	0	0	0	0	114.2	H216 Q242	H216-T218 PolarHBondContact O-N 3.01Å; T218-Q242 PolarHBondContact O-N 3.37Å
219	A	94.4	Very high	94.2	Very high	21 Å²	21	32.3 Å²	32.3	17%	0.174	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.7	179.4	0	0	0	0	0	111.1	L217 V243	L217-A219 VanDerWaalsContact C-N 3.29Å; L217-A219 PolarHBondContact O-N 3.15Å; A219-V243 WeakPolarHBondContact CA-O 3.36Å; A219-V243 HydrophobicContact CB-CG1 3.57Å
220	I	95.9	Very high	94	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.7	173.6	-53	-60.6	0	0	0	109.3	I198 L217 F225 M236 I241 V243 I244 E245 A248 F249	I198-I220 HydrophobicContact CD1-CD1 4.13Å; L217-I220 HydrophobicContact CB-CD1 4.18Å; L217-I220 HydrophobicContact CD1-CD1 4.46Å; I220-F225 HydrophobicContact CG2-CE2 3.7Å; I220-M236 HydrophobicContact CD1-SD 3.87Å; I220-M236 HydrophobicContact CG1-SD 4.42Å; I220-I241 HydrophobicContact CD1-CD1 4Å; I220-I241 HydrophobicContact CD1-CG1 4.15Å; I220-I241 HydrophobicContact CG1-CD1 3.93Å; I220-I241 HydrophobicContact CG1-CG1 4.16Å; I220-I241 HydrophobicContact CG1-CG2 3.89Å; I220-V243 PolarHBondContact N-O 3.42Å; I220-I244 HydrophobicContact CB-CB 4.47Å; I220-I244 HydrophobicContact CB-CG1 4.01Å; I220-I244 HydrophobicContact CB-CG2 4.36Å; I220-I244 HydrophobicContact CG1-CG1 4.05Å; I220-E245 PolarHBondContact O-N 2.81Å; I220-A248 HydrophobicContact CG2-CB 4.23Å; I220-F249 HydrophobicContact CG2-CE1 4Å; I220-F249 HydrophobicContact CG2-CZ 4.44Å
221	R	92.6	Very high	94	Very high	127 Å²	127	35.8 Å²	35.8	48%	0.479	20%	0.202	S	C	.	.			trans	-114.9	160.1	-174.1	-54.2	-153.2	168.9	90.5	4.5	112	S224 E245	R221-S224 WeakPolarHBondContact O-CB 3.41Å; R221-S224 PolarHBondContact O-N 3.47Å; R221-S224 PolarHBondContact O-OG 3.01Å; R221-E245 WeakPolarHBondContact CD-OE1 3.11Å; R221-E245 WeakPolarHBondContact CG-OE1 3.26Å; R221-E245 IonicContact CZ-OE1 2.65Å; R221-E245 IonicContact NE-OE1 2.72Å; R221-E245 PolarHBondContact NE-OE1 3.33Å; R221-E245 IonicContact NE-OE2 2.71Å
222	P	88	Confident	93.9	Very high	29 Å²	29	38.3 Å²	38.3	19%	0.188	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	156.8	160.4	-1.6	15.2	0	0	0	109.8	S224 H381	P222-S224 PolarHBondContact O-N 3.36Å; P222-S224 VanDerWaalsContact O-N 3.14Å; P222-H381 WeakPolarHBondContact CG-CE1 3.31Å; P222-H381 WeakPolarHBondContact CG-ND1 3.25Å
223	G	86.2	Confident	93.9	Very high	33 Å²	33	41.1 Å²	41.1	34%	0.34	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	-29.9	-174.4	0	0	0	0	0	114.4	F225 Q226	G223-F225 PolarHBondContact O-N 2.72Å; G223-Q226 VanDerWaalsContact O-CB 3.22Å; G223-Q226 WeakPolarHBondContact O-CB 3.34Å; G223-Q226 PolarHBondContact O-N 2.78Å
224	S	91.2	Very high	93.8	Very high	36 Å²	36	40.6 Å²	40.6	25%	0.252	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.9	179.5	-59.8	0	0	0	0	114.6	R221 P222	R221-S224 WeakPolarHBondContact O-CB 3.41Å; R221-S224 PolarHBondContact O-N 3.47Å; R221-S224 PolarHBondContact O-OG 3.01Å; P222-S224 PolarHBondContact O-N 3.36Å; P222-S224 VanDerWaalsContact O-N 3.14Å
225	F	93.3	Very high	93.9	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.009	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	27.5	173.3	-56	-74.4	0	0	0	113.1	I198 L210 L212 I220 G223 L228 L234 M236 F249 L252	I198-F225 HydrophobicContact CD1-CE1 3.67Å; I198-F225 HydrophobicContact CD1-CE2 3.97Å; I198-F225 HydrophobicContact CD1-CZ 3.31Å; L210-F225 HydrophobicContact CD2-CD1 4.29Å; L210-F225 HydrophobicContact CD2-CE1 4.13Å; L212-F225 HydrophobicContact CD1-CE1 3.95Å; L212-F225 HydrophobicContact CD1-CZ 4.43Å; I220-F225 HydrophobicContact CG2-CE2 3.7Å; G223-F225 PolarHBondContact O-N 2.72Å; F225-L228 HydrophobicContact CB-CD1 4.24Å; F225-L228 HydrophobicContact CD1-CD1 4.08Å; F225-L228 PolarHBondContact O-N 2.84Å; F225-L234 HydrophobicContact CD1-CD2 4.38Å; F225-L234 HydrophobicContact CE1-CD1 3.76Å; F225-L234 HydrophobicContact CE1-CD2 3.89Å; F225-L234 HydrophobicContact CE2-CD2 4.18Å; F225-L234 HydrophobicContact CZ-CD1 4.15Å; F225-L234 HydrophobicContact CZ-CD2 3.78Å; F225-M236 HydrophobicContact CZ-CE 4.26Å; F225-M236 HydrophobicContact CZ-SD 3.88Å; F225-F249 HydrophobicContact CD2-CD1 4.18Å; F225-F249 HydrophobicContact CD2-CE1 4.34Å; F225-F249 HydrophobicContact CE2-CD1 4.1Å; F225-F249 AromaticContact CE2-CE1 3.79Å; F225-F249 HydrophobicContact CE2-CE1 3.79Å; F225-L252 HydrophobicContact CB-CD1 4.2Å; F225-L252 HydrophobicContact CB-CD2 3.85Å; F225-L252 HydrophobicContact CB-CG 4.15Å; F225-L252 HydrophobicContact CD2-CD1 4.28Å; F225-L252 HydrophobicContact CG-CD1 4.18Å
226	Q	89.4	Confident	93.9	Very high	57 Å²	57	41.6 Å²	41.6	27%	0.266	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	140.2	179.2	-177.9	165.2	-25.9	0	0	111.8	T202 G223 L228	T202-Q226 HydrophobicContact CG2-CB 4.14Å; T202-Q226 HydrophobicContact CG2-CG 4.23Å; T202-Q226 WeakPolarHBondContact CG2-O 3.48Å; G223-Q226 VanDerWaalsContact O-CB 3.22Å; G223-Q226 WeakPolarHBondContact O-CB 3.34Å; G223-Q226 PolarHBondContact O-N 2.78Å; Q226-L228 PolarHBondContact O-N 2.97Å
227	G	87.3	Confident	93.9	Very high	26 Å²	26	41.1 Å²	41.1	27%	0.268	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	-15	-179.5	0	0	0	0	0	115.5	M229	G227-M229 PolarHBondContact O-N 2.98Å
228	L	94.3	Very high	94	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.245	C	C	.	.			trans	-80.5	42.6	-176.2	-57.5	-175.8	0	0	0	113.7	L201 L204 L207 L210 F225 Q226 H230 L231 L252	L201-L228 HydrophobicContact CB-CD1 4.09Å; L201-L228 HydrophobicContact CB-CD2 4.16Å; L201-L228 HydrophobicContact CB-CG 4.45Å; L201-L228 HydrophobicContact CD1-CD1 3.94Å; L204-L228 HydrophobicContact CB-CD2 4.25Å; L207-L228 HydrophobicContact CB-CD2 4.17Å; L207-L228 HydrophobicContact CD2-CD1 4.47Å; L207-L228 HydrophobicContact CD2-CD2 4.15Å; L210-L228 HydrophobicContact CD2-CD1 4.13Å; F225-L228 HydrophobicContact CB-CD1 4.24Å; F225-L228 HydrophobicContact CD1-CD1 4.08Å; F225-L228 PolarHBondContact O-N 2.84Å; Q226-L228 PolarHBondContact O-N 2.97Å; L228-H230 PolarHBondContact O-N 2.98Å; L228-H230 VanDerWaalsContact O-N 3.13Å; L228-L231 HydrophobicContact CB-CB 4.2Å; L228-L231 HydrophobicContact CD1-CD2 4.42Å; L228-L231 WeakPolarHBondContact O-CB 3.11Å; L228-L231 PolarHBondContact O-N 2.89Å; L228-L231 VanDerWaalsContact O-N 3.11Å; L228-L252 HydrophobicContact CB-CD2 3.84Å; L228-L252 WeakPolarHBondContact O-CD2 3.19Å
229	M	91.8	Very high	94.1	Very high	99 Å²	99	43.7 Å²	43.7	49%	0.488	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.2	-174.1	-64.8	-180	176.2	0	0	113.9	G227 S254	G227-M229 PolarHBondContact O-N 2.98Å; M229-S254 VanDerWaalsContact O-CB 3.24Å; M229-S254 WeakPolarHBondContact O-CB 3.25Å; M229-S254 PolarHBondContact O-N 2.8Å; M229-S254 PolarHBondContact O-OG 2.82Å
230	H	95.4	Very high	94.2	Very high	114 Å²	114	47.4 Å²	47.4	53%	0.528	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-2.8	179.9	-74.8	-64.5	0	0	0	114.7	V205 L207 L228 Q232	V205-H230 PolarHBondContact O-CD2 2.99Å; L207-H230 CarbonylContact O-C 3.58Å; L228-H230 PolarHBondContact O-N 2.98Å; L228-H230 VanDerWaalsContact O-N 3.13Å; H230-Q232 PolarHBondContact O-N 3.09Å
231	L	97.3	Very high	94.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.237	C	C	.	.			trans	-67.3	124	-175.7	-169.9	75.7	0	0	0	111.1	L207 L210 L228 L234 L252 S254 L255	L207-L231 HydrophobicContact CB-CD1 4.27Å; L207-L231 HydrophobicContact CD2-CD1 4.06Å; L207-L231 HydrophobicContact CG-CD1 3.96Å; L207-L231 VanDerWaalsContact O-CA 3.32Å; L207-L231 WeakPolarHBondContact O-CA 3.38Å; L207-L231 PolarHBondContact O-N 3.04Å; L210-L231 HydrophobicContact CB-CD1 3.75Å; L210-L231 HydrophobicContact CB-CD2 4.28Å; L210-L231 HydrophobicContact CD2-CD2 4.42Å; L228-L231 HydrophobicContact CB-CB 4.2Å; L228-L231 HydrophobicContact CD1-CD2 4.42Å; L228-L231 WeakPolarHBondContact O-CB 3.11Å; L228-L231 PolarHBondContact O-N 2.89Å; L228-L231 VanDerWaalsContact O-N 3.11Å; L231-L234 HydrophobicContact CD2-CB 4.12Å; L231-L234 HydrophobicContact CD2-CD1 4.42Å; L231-L252 HydrophobicContact CB-CD2 4.15Å; L231-L252 HydrophobicContact CD2-CD2 3.88Å; L231-S254 CarbonylContact O-C 3.13Å; L231-S254 VanDerWaalsContact O-C 3.24Å; L231-L255 HydrophobicContact CD2-CD1 4.26Å; L231-L255 HydrophobicContact CG-CD1 4.3Å; L231-L255 VanDerWaalsContact O-CA 3.3Å; L231-L255 WeakPolarHBondContact O-CA 3.33Å; L231-L255 PolarHBondContact O-N 2.73Å
232	Q	96.9	Very high	94.4	Very high	84 Å²	84	46.7 Å²	46.7	39%	0.393	24%	0.24	S	C	.	.			trans	-99.5	-31.8	179	-61.8	-175.2	22.3	0	0	112.7	D208 H230 V256 E257	D208-Q232 PolarHBondContact O-N 3.02Å; D208-Q232 VanDerWaalsContact OD1-CD 3.24Å; D208-Q232 WeakPolarHBondContact OD1-CG 3.31Å; D208-Q232 PolarHBondContact OD1-NE2 2.91Å; H230-Q232 PolarHBondContact O-N 3.09Å; Q232-V256 HydrophobicContact CB-CG2 4.32Å; Q232-V256 PolarHBondContact O-N 2.83Å; Q232-E257 PolarHBondContact O-N 2.89Å
233	K	97.8	Very high	94.7	Very high	58 Å²	58	48.6 Å²	48.6	25%	0.252	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.3	-175.8	-49.1	-173.9	-166	156.5	0	112.2	D208 E209 L210 W235 E257	D208-K233 PolarHBondContact O-N 3.32Å; E209-K233 HydrophobicContact CG-CB 4.28Å; E209-K233 HydrophobicContact CG-CD 4.06Å; E209-K233 HydrophobicContact CG-CG 4.29Å; E209-K233 WeakPolarHBondContact OE1-CE 3.43Å; E209-K233 IonicContact OE1-NZ 2.74Å; E209-K233 PolarHBondContact OE1-NZ 3.03Å; L210-K233 PolarHBondContact N-O 3.36Å; K233-W235 HydrophobicContact CB-CH2 4.02Å; K233-W235 HydrophobicContact CB-CZ2 3.79Å; K233-W235 HydrophobicContact CD-CH2 3.92Å; K233-W235 HydrophobicContact CD-CZ2 3.58Å; K233-W235 HydrophobicContact CG-CZ2 4.32Å; K233-E257 WeakPolarHBondContact CA-O 3.47Å; K233-E257 HydrophobicContact CB-CB 4.5Å; K233-E257 HydrophobicContact CG-CB 4.19Å
234	L	97.9	Very high	95.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	110.4	179.9	177.8	55.5	0	0	0	110.6	L210 L212 F225 L231 M236 F249 L252 L255 E257 I258 N259	L210-L234 HydrophobicContact CB-CD1 4.29Å; L210-L234 HydrophobicContact CD2-CD1 3.96Å; L210-L234 HydrophobicContact CG-CD1 4.1Å; L212-L234 HydrophobicContact CD1-CD1 4.45Å; F225-L234 HydrophobicContact CD1-CD2 4.38Å; F225-L234 HydrophobicContact CE1-CD1 3.76Å; F225-L234 HydrophobicContact CE1-CD2 3.89Å; F225-L234 HydrophobicContact CE2-CD2 4.18Å; F225-L234 HydrophobicContact CZ-CD1 4.15Å; F225-L234 HydrophobicContact CZ-CD2 3.78Å; L231-L234 HydrophobicContact CD2-CB 4.12Å; L231-L234 HydrophobicContact CD2-CD1 4.42Å; L234-M236 HydrophobicContact CD1-CE 4.49Å; L234-M236 HydrophobicContact CD1-CG 4.23Å; L234-M236 HydrophobicContact CD2-CE 3.82Å; L234-M236 HydrophobicContact CG-CE 3.95Å; L234-M236 HydrophobicContact CG-CG 4.46Å; L234-F249 HydrophobicContact CD2-CE1 4.37Å; L234-L252 HydrophobicContact CD2-CD1 3.75Å; L234-L255 HydrophobicContact CB-CD1 3.86Å; L234-E257 PolarHBondContact N-O 2.93Å; L234-I258 HydrophobicContact CB-CG1 4.49Å; L234-I258 HydrophobicContact CD2-CD1 4.46Å; L234-N259 PolarHBondContact O-N 3.13Å
235	W	98.3	Very high	95.3	Very high	45 Å²	45	47.2 Å²	47.2	17%	0.17	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.4	178.5	-52.5	-69.7	0	0	0	110.8	Y187 E209 L210 D211 L212 K233 E257	Y187-W235 HydrophobicContact CE2-CZ3 4.34Å; E209-W235 HydrophobicContact CB-CH2 4.02Å; E209-W235 HydrophobicContact CB-CZ3 3.91Å; E209-W235 HydrophobicContact CG-CH2 4.21Å; L210-W235 PolarHBondContact O-N 3.07Å; D211-W235 HydrophobicContact CB-CE3 3.91Å; L212-W235 PolarHBondContact N-O 3.1Å; K233-W235 HydrophobicContact CB-CH2 4.02Å; K233-W235 HydrophobicContact CB-CZ2 3.79Å; K233-W235 HydrophobicContact CD-CH2 3.92Å; K233-W235 HydrophobicContact CD-CZ2 3.58Å; K233-W235 HydrophobicContact CG-CZ2 4.32Å; W235-E257 PolarHBondContact NE1-OE1 3.16Å
236	M	97.1	Very high	95.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.233	C	C	.	.			trans	-133.7	45.5	177	-65.9	-176.7	-77.9	0	0	109.8	L212 I220 F225 L234 Q238 S239 I241 F249 N259 L260 N263	L212-M236 HydrophobicContact CB-CG 4.13Å; I220-M236 HydrophobicContact CD1-SD 3.87Å; I220-M236 HydrophobicContact CG1-SD 4.42Å; F225-M236 HydrophobicContact CZ-CE 4.26Å; F225-M236 HydrophobicContact CZ-SD 3.88Å; L234-M236 HydrophobicContact CD1-CE 4.49Å; L234-M236 HydrophobicContact CD1-CG 4.23Å; L234-M236 HydrophobicContact CD2-CE 3.82Å; L234-M236 HydrophobicContact CG-CE 3.95Å; L234-M236 HydrophobicContact CG-CG 4.46Å; M236-Q238 PolarHBondContact O-N 2.93Å; M236-S239 PolarHBondContact O-OG 3.45Å; M236-I241 HydrophobicContact CB-CD1 3.9Å; M236-I241 HydrophobicContact CE-CD1 4.49Å; M236-I241 HydrophobicContact SD-CD1 3.96Å; M236-F249 HydrophobicContact CE-CE1 3.93Å; M236-F249 HydrophobicContact CE-CZ 3.97Å; M236-N259 CarbonylContact C-O 3.23Å; M236-N259 PolarHBondContact N-O 2.99Å; M236-L260 HydrophobicContact CB-CD2 4.41Å; M236-L260 HydrophobicContact CE-CD2 3.6Å; M236-L260 HydrophobicContact CE-CG 4.47Å; M236-N263 PolarHBondContact O-ND2 3.23Å
237	I	97.1	Very high	95.4	Very high	54 Å²	54	46.5 Å²	46.5	28%	0.277	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	130.1	-175.1	-55.7	162.7	0	0	0	108.9	S213 G214 S239 N259 A261 H262	S213-I237 CarbonylContact C-O 3.36Å; S213-I237 VanDerWaalsContact CA-O 3.24Å; S213-I237 WeakPolarHBondContact CA-O 3.41Å; S213-I237 VanDerWaalsContact CB-O 3.29Å; S213-I237 WeakPolarHBondContact CB-O 3.42Å; S213-I237 PolarHBondContact OG-N 3.39Å; G214-I237 PolarHBondContact N-O 2.85Å; I237-S239 PolarHBondContact O-N 2.98Å; I237-N259 HydrophobicContact CG1-CB 4.17Å; I237-N259 VanDerWaalsContact CG1-CG 3.49Å; I237-N259 WeakPolarHBondContact CG1-OD1 3.43Å; I237-A261 CarbonylContact C-O 3.57Å; I237-A261 WeakPolarHBondContact CA-O 3.36Å; I237-A261 HydrophobicContact CG2-CB 4.4Å; I237-H262 HydrophobicContact CG2-CB 4.47Å
238	Q	96.9	Very high	95.7	Very high	129 Å²	129	45.4 Å²	45.4	60%	0.603	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	28.9	175.8	-156.1	-175.9	-28.4	0	0	114.1	M236 Q240 A261 H262	M236-Q238 PolarHBondContact O-N 2.93Å; Q238-Q240 VanDerWaalsContact C-N 3.25Å; Q238-Q240 PolarHBondContact O-N 3.15Å; Q238-A261 PolarHBondContact N-O 2.84Å; Q238-H262 WeakPolarHBondContact CA-O 3.2Å; Q238-H262 HydrophobicContact CB-CB 4.01Å; Q238-H262 HydrophobicContact CG-CB 4.29Å
239	S	97.3	Very high	95.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.			trans	-86.3	13.9	-179.1	-59	0	0	0	0	114.4	L212 S213 G214 N215 L217 M236 I237 I241 N263	L212-S239 PolarHBondContact O-OG 2.03Å; S213-S239 WeakPolarHBondContact CA-OG 3.47Å; G214-S239 PolarHBondContact N-OG 2.93Å; N215-S239 CarbonylContact O-C 3.55Å; N215-S239 VanDerWaalsContact O-CA 3.27Å; N215-S239 WeakPolarHBondContact O-CA 3.22Å; L217-S239 PolarHBondContact N-O 2.98Å; M236-S239 PolarHBondContact O-OG 3.45Å; I237-S239 PolarHBondContact O-N 2.98Å; S239-I241 PolarHBondContact O-N 3.42Å; S239-N263 WeakPolarHBondContact CA-OD1 3.44Å; S239-N263 PolarHBondContact N-OD1 3.05Å
240	Q	96.3	Very high	95.7	Very high	99 Å²	99	42.2 Å²	42.2	46%	0.463	20%	0.202	S	C	.	.			trans	61	23.4	177	-53.3	-174.1	-9.4	0	0	115.4	H216 Q238 Q242 N263	H216-Q240 VanDerWaalsContact ND1-CD 3.28Å; H216-Q240 PolarHBondContact ND1-NE2 2.96Å; H216-Q240 PolarHBondContact ND1-OE1 3.13Å; Q238-Q240 VanDerWaalsContact C-N 3.25Å; Q238-Q240 PolarHBondContact O-N 3.15Å; Q240-Q242 PolarHBondContact O-N 2.69Å; Q240-N263 PolarHBondContact N-OD1 2.98Å
241	I	97.6	Very high	95.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.186	C	C	.	.			trans	-63.5	127.1	179.8	-53.4	164.3	0	0	0	109.9	L217 I220 M236 S239 V243 I244 L260 N263 N264 L265	L217-I241 HydrophobicContact CB-CG1 4.37Å; L217-I241 VanDerWaalsContact O-CA 3.24Å; L217-I241 WeakPolarHBondContact O-CA 3.49Å; L217-I241 VanDerWaalsContact O-CG1 3.22Å; L217-I241 WeakPolarHBondContact O-CG1 3.42Å; I220-I241 HydrophobicContact CD1-CD1 4Å; I220-I241 HydrophobicContact CD1-CG1 4.15Å; I220-I241 HydrophobicContact CG1-CD1 3.93Å; I220-I241 HydrophobicContact CG1-CG1 4.16Å; I220-I241 HydrophobicContact CG1-CG2 3.89Å; M236-I241 HydrophobicContact CB-CD1 3.9Å; M236-I241 HydrophobicContact CE-CD1 4.49Å; M236-I241 HydrophobicContact SD-CD1 3.96Å; S239-I241 PolarHBondContact O-N 3.42Å; I241-V243 WeakPolarHBondContact CG2-O 3.42Å; I241-I244 HydrophobicContact CG2-CG1 3.99Å; I241-L260 HydrophobicContact CD1-CD2 3.71Å; I241-N263 HydrophobicContact CB-CB 4.14Å; I241-N263 PolarHBondContact N-OD1 3.05Å; I241-N264 CarbonylContact O-C 3.26Å; I241-N264 VanDerWaalsContact O-C 3.29Å; I241-N264 WeakPolarHBondContact O-CA 3.35Å; I241-N264 PolarHBondContact O-N 2.8Å; I241-L265 HydrophobicContact CB-CD2 4.45Å; I241-L265 HydrophobicContact CG2-CD2 3.76Å; I241-L265 HydrophobicContact CG2-CG 4.47Å; I241-L265 PolarHBondContact O-N 3.01Å
242	Q	95.6	Very high	95.1	Very high	114 Å²	114	38.6 Å²	38.6	53%	0.533	19%	0.186	S	C	.	.			trans	-105.1	-35.3	175.9	-56.1	-174.9	9.6	0	0	111.7	T218 Q240 N264	T218-Q242 PolarHBondContact O-N 3.37Å; Q240-Q242 PolarHBondContact O-N 2.69Å; Q242-N264 HydrophobicContact CG-CB 4.29Å
243	V	94.2	Very high	94.7	Very high	68 Å²	68	40.4 Å²	40.4	41%	0.412	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.6	-178.6	64.5	0	0	0	0	111.1	A219 I220 I241	A219-V243 WeakPolarHBondContact CA-O 3.36Å; A219-V243 HydrophobicContact CB-CG1 3.57Å; I220-V243 PolarHBondContact N-O 3.42Å; I241-V243 WeakPolarHBondContact CG2-O 3.42Å
244	I	96.1	Very high	94.6	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.1	164.9	-65.2	162	0	0	0	105.5	I220 I241 A248 F249 L260 L265 L268 P269 L272	I220-I244 HydrophobicContact CB-CB 4.47Å; I220-I244 HydrophobicContact CB-CG1 4.01Å; I220-I244 HydrophobicContact CB-CG2 4.36Å; I220-I244 HydrophobicContact CG1-CG1 4.05Å; I241-I244 HydrophobicContact CG2-CG1 3.99Å; I244-A248 HydrophobicContact CG2-CB 3.81Å; I244-F249 HydrophobicContact CD1-CE2 4.13Å; I244-F249 HydrophobicContact CD1-CZ 4.03Å; I244-F249 HydrophobicContact CG1-CZ 4.5Å; I244-F249 HydrophobicContact CG2-CE2 4Å; I244-F249 HydrophobicContact CG2-CZ 4.1Å; I244-L260 HydrophobicContact CD1-CD1 3.78Å; I244-L260 HydrophobicContact CD1-CD2 3.96Å; I244-L265 HydrophobicContact CD1-CD1 4.03Å; I244-L265 HydrophobicContact CD1-CD2 3.88Å; I244-L265 HydrophobicContact CG1-CD2 4.02Å; I244-L268 HydrophobicContact CD1-CD2 3.72Å; I244-P269 VanDerWaalsContact O-CD 3.31Å; I244-P269 WeakPolarHBondContact O-CD 3.31Å; I244-P269 WeakPolarHBondContact O-CG 3.38Å; I244-L272 HydrophobicContact CG2-CD1 4.15Å; I244-L272 HydrophobicContact CG2-CD2 3.92Å
245	E	93.6	Very high	94.5	Very high	38 Å²	38	39.9 Å²	39.9	18%	0.178	20%	0.198	C	C	.	.			trans	-76.6	162.1	-177.8	-66.8	176.7	-168.9	0	0	111.5	I220 R221 N247 A248 H381	I220-E245 PolarHBondContact O-N 2.81Å; R221-E245 WeakPolarHBondContact CD-OE1 3.11Å; R221-E245 WeakPolarHBondContact CG-OE1 3.26Å; R221-E245 IonicContact CZ-OE1 2.65Å; R221-E245 IonicContact NE-OE1 2.72Å; R221-E245 PolarHBondContact NE-OE1 3.33Å; R221-E245 IonicContact NE-OE2 2.71Å; E245-N247 PolarHBondContact O-N 3.35Å; E245-A248 VanDerWaalsContact O-CB 3.3Å; E245-A248 WeakPolarHBondContact O-CB 3.48Å; E245-A248 PolarHBondContact O-N 2.9Å; E245-H381 IonicContact OE2-CE1 3.46Å; E245-H381 PolarHBondContact OE2-CE1 3.32Å
246	R	91.3	Very high	94.2	Very high	12 Å²	12	39.5 Å²	39.5	5%	0.045	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	136.5	176.5	-68.5	164.7	167.6	156.5	-10	110.5	A248 P269 T364 S365 T367 V369 H381 S392 D393	R246-A248 PolarHBondContact O-N 3.45Å; R246-A248 VanDerWaalsContact O-N 3.14Å; R246-P269 HydrophobicContact CG-CB 4.49Å; R246-T364 PolarHBondContact NH2-O 2.86Å; R246-S365 PolarHBondContact NE-O 3.37Å; R246-S365 VanDerWaalsContact NE-O 3.07Å; R246-S365 PolarHBondContact NH2-O 3.26Å; R246-T367 PolarHBondContact NE-O 3.15Å; R246-T367 PolarHBondContact NH2-O 2.97Å; R246-T367 VanDerWaalsContact NH2-O 3.13Å; R246-T367 PolarHBondContact NH2-OG1 3.34Å; R246-V369 VanDerWaalsContact CZ-CG2 3.48Å; R246-V369 VanDerWaalsContact NH2-CG2 3.26Å; R246-H381 HydrophobicContact CB-CB 3.95Å; R246-H381 PolarHBondContact O-ND1 3.18Å; R246-S392 PolarHBondContact NH1-O 2.65Å; R246-D393 PolarHBondContact NH1-O 2.72Å
247	N	93	Very high	94.1	Very high	31 Å²	31	40.6 Å²	40.6	17%	0.166	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	20.4	175.2	-54.7	101	0	0	0	116	E245 F249 D250 H381 G382	E245-N247 PolarHBondContact O-N 3.35Å; N247-F249 PolarHBondContact O-N 2.9Å; N247-D250 WeakPolarHBondContact CA-OD1 3.09Å; N247-D250 WeakPolarHBondContact CB-OD2 3.42Å; N247-D250 PolarHBondContact ND2-OD2 2.78Å; N247-D250 PolarHBondContact O-N 2.87Å; N247-H381 HydrophobicContact CB-CB 4.31Å; N247-H381 PolarHBondContact OD1-N 2.87Å; N247-G382 VanDerWaalsContact CB-N 3.28Å
248	A	94.3	Very high	94	Very high	3 Å²	3	38.1 Å²	38.1	3%	0.025	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.7	-173.1	0	0	0	0	0	115	I220 I244 E245 R246	I220-A248 HydrophobicContact CG2-CB 4.23Å; I244-A248 HydrophobicContact CG2-CB 3.81Å; E245-A248 VanDerWaalsContact O-CB 3.3Å; E245-A248 WeakPolarHBondContact O-CB 3.48Å; E245-A248 PolarHBondContact O-N 2.9Å; R246-A248 PolarHBondContact O-N 3.45Å; R246-A248 VanDerWaalsContact O-N 3.14Å
249	F	94.9	Very high	93.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-4.8	-178	-59.6	-45.7	0	0	0	114.6	I220 F225 L234 M236 I244 N247 N251 L252 I258 L260 L272 F273 L276	I220-F249 HydrophobicContact CG2-CE1 4Å; I220-F249 HydrophobicContact CG2-CZ 4.44Å; F225-F249 HydrophobicContact CD2-CD1 4.18Å; F225-F249 HydrophobicContact CD2-CE1 4.34Å; F225-F249 HydrophobicContact CE2-CD1 4.1Å; F225-F249 AromaticContact CE2-CE1 3.79Å; F225-F249 HydrophobicContact CE2-CE1 3.79Å; L234-F249 HydrophobicContact CD2-CE1 4.37Å; M236-F249 HydrophobicContact CE-CE1 3.93Å; M236-F249 HydrophobicContact CE-CZ 3.97Å; I244-F249 HydrophobicContact CD1-CE2 4.13Å; I244-F249 HydrophobicContact CD1-CZ 4.03Å; I244-F249 HydrophobicContact CG1-CZ 4.5Å; I244-F249 HydrophobicContact CG2-CE2 4Å; I244-F249 HydrophobicContact CG2-CZ 4.1Å; N247-F249 PolarHBondContact O-N 2.9Å; F249-N251 PolarHBondContact O-N 2.89Å; F249-L252 HydrophobicContact CB-CD1 4.35Å; F249-L252 HydrophobicContact CD1-CD1 4.01Å; F249-L252 VanDerWaalsContact O-CB 3.28Å; F249-L252 WeakPolarHBondContact O-CB 3.18Å; F249-L252 PolarHBondContact O-N 2.95Å; F249-I258 HydrophobicContact CD2-CD1 4.12Å; F249-I258 HydrophobicContact CE1-CD1 4.15Å; F249-I258 HydrophobicContact CE2-CD1 3.71Å; F249-I258 HydrophobicContact CZ-CD1 3.74Å; F249-L260 HydrophobicContact CE2-CD1 4.41Å; F249-L260 HydrophobicContact CZ-CD1 4.49Å; F249-L272 HydrophobicContact CD2-CD1 3.76Å; F249-L272 HydrophobicContact CD2-CD2 4.03Å; F249-L272 HydrophobicContact CD2-CG 3.84Å; F249-L272 HydrophobicContact CE2-CD1 4.33Å; F249-L272 HydrophobicContact CE2-CD2 3.91Å; F249-L272 HydrophobicContact CE2-CG 4.25Å; F249-L272 HydrophobicContact CG-CD1 4.47Å; F249-F273 HydrophobicContact CD2-CE1 4.14Å; F249-F273 HydrophobicContact CE2-CE1 4.16Å; F249-L276 HydrophobicContact CB-CD1 3.92Å
250	D	90.3	Very high	93.8	Very high	34 Å²	34	32.8 Å²	32.8	18%	0.182	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.9	-170.9	-64.3	25	0	0	0	114.7	N247 L252	N247-D250 WeakPolarHBondContact CA-OD1 3.09Å; N247-D250 WeakPolarHBondContact CB-OD2 3.42Å; N247-D250 PolarHBondContact ND2-OD2 2.78Å; N247-D250 PolarHBondContact O-N 2.87Å; D250-L252 VanDerWaalsContact C-N 3.28Å; D250-L252 PolarHBondContact O-N 3Å
251	N	86.9	Confident	93.8	Very high	38 Å²	38	28.1 Å²	28.1	20%	0.203	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.8	176.3	-69.1	-28.4	0	0	0	113.8	F249 Q253	F249-N251 PolarHBondContact O-N 2.89Å; N251-Q253 VanDerWaalsContact C-N 3.28Å; N251-Q253 PolarHBondContact O-N 2.68Å; N251-Q253 VanDerWaalsContact O-N 3.1Å
252	L	93.4	Very high	93.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.			trans	-88.8	54.5	-172.8	-60.7	177.9	0	0	0	111.7	F225 L228 L231 L234 F249 D250 S254 L255	F225-L252 HydrophobicContact CB-CD1 4.2Å; F225-L252 HydrophobicContact CB-CD2 3.85Å; F225-L252 HydrophobicContact CB-CG 4.15Å; F225-L252 HydrophobicContact CD2-CD1 4.28Å; F225-L252 HydrophobicContact CG-CD1 4.18Å; L228-L252 HydrophobicContact CB-CD2 3.84Å; L228-L252 WeakPolarHBondContact O-CD2 3.19Å; L231-L252 HydrophobicContact CB-CD2 4.15Å; L231-L252 HydrophobicContact CD2-CD2 3.88Å; L234-L252 HydrophobicContact CD2-CD1 3.75Å; F249-L252 HydrophobicContact CB-CD1 4.35Å; F249-L252 HydrophobicContact CD1-CD1 4.01Å; F249-L252 VanDerWaalsContact O-CB 3.28Å; F249-L252 WeakPolarHBondContact O-CB 3.18Å; F249-L252 PolarHBondContact O-N 2.95Å; D250-L252 VanDerWaalsContact C-N 3.28Å; D250-L252 PolarHBondContact O-N 3Å; L252-S254 PolarHBondContact O-N 3.47Å; L252-S254 VanDerWaalsContact O-N 3.1Å; L252-L255 HydrophobicContact CB-CB 4.01Å; L252-L255 HydrophobicContact CB-CD2 4.22Å; L252-L255 HydrophobicContact CD1-CD2 3.98Å; L252-L255 WeakPolarHBondContact O-CB 3.42Å; L252-L255 PolarHBondContact O-N 2.67Å
253	Q	89.4	Confident	93.8	Very high	123 Å²	123	27.1 Å²	27.1	58%	0.575	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.9	-169.9	-62	-179.5	5.7	0	0	114.7	N251	N251-Q253 VanDerWaalsContact C-N 3.28Å; N251-Q253 PolarHBondContact O-N 2.68Å; N251-Q253 VanDerWaalsContact O-N 3.1Å
254	S	95.1	Very high	94	Very high	46 Å²	46	27.9 Å²	27.9	32%	0.322	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	6.6	176.8	-54.1	0	0	0	0	114.2	M229 L231 L252 V256	M229-S254 VanDerWaalsContact O-CB 3.24Å; M229-S254 WeakPolarHBondContact O-CB 3.25Å; M229-S254 PolarHBondContact O-N 2.8Å; M229-S254 PolarHBondContact O-OG 2.82Å; L231-S254 CarbonylContact O-C 3.13Å; L231-S254 VanDerWaalsContact O-C 3.24Å; L252-S254 PolarHBondContact O-N 3.47Å; L252-S254 VanDerWaalsContact O-N 3.1Å; S254-V256 PolarHBondContact O-N 2.92Å
255	L	95.6	Very high	94	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.			trans	-72.3	123.2	-170.3	-161.3	71.7	0	0	0	112.4	L231 L234 L252 I258 L276 R277 L278	L231-L255 HydrophobicContact CD2-CD1 4.26Å; L231-L255 HydrophobicContact CG-CD1 4.3Å; L231-L255 VanDerWaalsContact O-CA 3.3Å; L231-L255 WeakPolarHBondContact O-CA 3.33Å; L231-L255 PolarHBondContact O-N 2.73Å; L234-L255 HydrophobicContact CB-CD1 3.86Å; L252-L255 HydrophobicContact CB-CB 4.01Å; L252-L255 HydrophobicContact CB-CD2 4.22Å; L252-L255 HydrophobicContact CD1-CD2 3.98Å; L252-L255 WeakPolarHBondContact O-CB 3.42Å; L252-L255 PolarHBondContact O-N 2.67Å; L255-I258 HydrophobicContact CD2-CB 4.09Å; L255-I258 HydrophobicContact CD2-CD1 4.17Å; L255-I258 HydrophobicContact CD2-CG1 4.4Å; L255-L276 HydrophobicContact CD2-CD1 4.41Å; L255-R277 CarbonylContact O-C 3.58Å; L255-R277 VanDerWaalsContact O-C 3.26Å; L255-L278 HydrophobicContact CB-CD2 4.31Å; L255-L278 HydrophobicContact CD2-CD2 3.97Å; L255-L278 HydrophobicContact CG-CD2 3.88Å; L255-L278 PolarHBondContact O-N 2.79Å
256	V	93.6	Very high	94.1	Very high	37 Å²	37	29 Å²	29	22%	0.224	15%	0.154	C	C	.	.			trans	-107.1	-38.9	-177.3	-178.4	0	0	0	0	111.4	Q232 S254 E279 R280	Q232-V256 HydrophobicContact CB-CG2 4.32Å; Q232-V256 PolarHBondContact O-N 2.83Å; S254-V256 PolarHBondContact O-N 2.92Å; V256-E279 HydrophobicContact CG1-CB 3.85Å; V256-E279 HydrophobicContact CG1-CG 3.85Å; V256-E279 PolarHBondContact O-N 3.12Å; V256-R280 PolarHBondContact O-N 3.44Å
257	E	93.7	Very high	94.2	Very high	24 Å²	24	29.3 Å²	29.3	11%	0.112	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.5	-176.3	-172.7	177.4	117.7	0	0	111.1	Q232 K233 L234 W235 R280	Q232-E257 PolarHBondContact O-N 2.89Å; K233-E257 WeakPolarHBondContact CA-O 3.47Å; K233-E257 HydrophobicContact CB-CB 4.5Å; K233-E257 HydrophobicContact CG-CB 4.19Å; L234-E257 PolarHBondContact N-O 2.93Å; W235-E257 PolarHBondContact NE1-OE1 3.16Å; E257-R280 WeakPolarHBondContact CA-O 3.39Å; E257-R280 HydrophobicContact CB-CB 4.13Å; E257-R280 HydrophobicContact CG-CB 3.87Å; E257-R280 WeakPolarHBondContact OE2-CD 3.41Å; E257-R280 IonicContact OE2-CZ 3.27Å; E257-R280 IonicContact OE2-NE 2.77Å; E257-R280 IonicContact OE2-NH1 2.79Å; E257-R280 PolarHBondContact OE2-NH1 2.93Å
258	I	94.4	Very high	94.3	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.8	172.5	-165.7	173.7	0	0	0	111.6	L234 F249 L255 L260 L278 R280 I281 H282	L234-I258 HydrophobicContact CB-CG1 4.49Å; L234-I258 HydrophobicContact CD2-CD1 4.46Å; F249-I258 HydrophobicContact CD2-CD1 4.12Å; F249-I258 HydrophobicContact CE1-CD1 4.15Å; F249-I258 HydrophobicContact CE2-CD1 3.71Å; F249-I258 HydrophobicContact CZ-CD1 3.74Å; L255-I258 HydrophobicContact CD2-CB 4.09Å; L255-I258 HydrophobicContact CD2-CD1 4.17Å; L255-I258 HydrophobicContact CD2-CG1 4.4Å; I258-L260 HydrophobicContact CD1-CD1 4.13Å; I258-L260 HydrophobicContact CD1-CG 4.4Å; I258-L260 HydrophobicContact CG1-CG 4.37Å; I258-L278 HydrophobicContact CB-CD2 4.02Å; I258-L278 HydrophobicContact CG2-CD1 3.73Å; I258-L278 HydrophobicContact CG2-CD2 3.78Å; I258-L278 HydrophobicContact CG2-CG 4.43Å; I258-R280 PolarHBondContact N-O 3.02Å; I258-R280 VanDerWaalsContact N-O 3.13Å; I258-I281 HydrophobicContact CG2-CB 4.29Å; I258-I281 HydrophobicContact CG2-CD1 4.04Å; I258-I281 HydrophobicContact CG2-CG1 3.89Å; I258-I281 WeakPolarHBondContact O-CA 3.08Å; I258-H282 PolarHBondContact O-N 3.02Å
259	N	95.3	Very high	94.4	Very high	16 Å²	16	27.9 Å²	27.9	9%	0.086	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	108.5	179.6	-162.3	-27.1	0	0	0	112	L234 M236 I237 A261 H282	L234-N259 PolarHBondContact O-N 3.13Å; M236-N259 CarbonylContact C-O 3.23Å; M236-N259 PolarHBondContact N-O 2.99Å; I237-N259 HydrophobicContact CG1-CB 4.17Å; I237-N259 VanDerWaalsContact CG1-CG 3.49Å; I237-N259 WeakPolarHBondContact CG1-OD1 3.43Å; N259-A261 WeakPolarHBondContact OD1-CB 3.16Å; N259-A261 PolarHBondContact OD1-N 3.03Å; N259-A261 VanDerWaalsContact OD1-N 3.11Å; N259-H282 HydrophobicContact CB-CB 4.18Å; N259-H282 VanDerWaalsContact CG-CB 3.5Å; N259-H282 VanDerWaalsContact OD1-CB 3.31Å; N259-H282 WeakPolarHBondContact OD1-CB 3.19Å
260	L	95.9	Very high	94.3	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	16%	0.155	C	C	.	.			trans	-112.7	19.1	-180	-74.8	167.3	0	0	0	111.4	M236 I241 I244 F249 I258 N263 L265 F273 H282 L283 N286	M236-L260 HydrophobicContact CB-CD2 4.41Å; M236-L260 HydrophobicContact CE-CD2 3.6Å; M236-L260 HydrophobicContact CE-CG 4.47Å; I241-L260 HydrophobicContact CD1-CD2 3.71Å; I244-L260 HydrophobicContact CD1-CD1 3.78Å; I244-L260 HydrophobicContact CD1-CD2 3.96Å; F249-L260 HydrophobicContact CE2-CD1 4.41Å; F249-L260 HydrophobicContact CZ-CD1 4.49Å; I258-L260 HydrophobicContact CD1-CD1 4.13Å; I258-L260 HydrophobicContact CD1-CG 4.4Å; I258-L260 HydrophobicContact CG1-CG 4.37Å; L260-N263 VanDerWaalsContact C-ND2 3.3Å; L260-N263 PolarHBondContact O-ND2 3.13Å; L260-L265 HydrophobicContact CB-CD1 4.08Å; L260-L265 HydrophobicContact CD1-CD1 4.32Å; L260-L265 HydrophobicContact CD2-CD1 4.32Å; L260-L265 HydrophobicContact CG-CD1 4.49Å; L260-F273 HydrophobicContact CD1-CZ 4.5Å; L260-H282 CarbonylContact C-O 3.22Å; L260-H282 PolarHBondContact N-O 3.39Å; L260-L283 HydrophobicContact CB-CD2 4.06Å; L260-L283 HydrophobicContact CD1-CD2 4.05Å; L260-N286 PolarHBondContact O-ND2 3.47Å
261	A	95.6	Very high	94.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	153	-176.8	0	0	0	0	0	114	I237 Q238 N259 N263 H282 H284	I237-A261 CarbonylContact C-O 3.57Å; I237-A261 WeakPolarHBondContact CA-O 3.36Å; I237-A261 HydrophobicContact CG2-CB 4.4Å; Q238-A261 PolarHBondContact N-O 2.84Å; N259-A261 WeakPolarHBondContact OD1-CB 3.16Å; N259-A261 PolarHBondContact OD1-N 3.03Å; N259-A261 VanDerWaalsContact OD1-N 3.11Å; A261-N263 PolarHBondContact O-N 2.9Å; A261-N263 PolarHBondContact O-ND2 3Å; A261-H282 PolarHBondContact N-O 2.83Å; A261-H284 WeakPolarHBondContact CA-O 3.29Å; A261-H284 WeakPolarHBondContact CB-CE1 3.27Å; A261-H284 WeakPolarHBondContact CB-ND1 3.32Å
262	H	96.4	Very high	94.7	Very high	83 Å²	83	29 Å²	29	38%	0.384	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	24.1	175.4	-54.6	102.8	0	0	0	114.8	I237 Q238 H284 H285	I237-H262 HydrophobicContact CG2-CB 4.47Å; Q238-H262 WeakPolarHBondContact CA-O 3.2Å; Q238-H262 HydrophobicContact CB-CB 4.01Å; Q238-H262 HydrophobicContact CG-CB 4.29Å; H262-H284 AromaticContact CE1-CE1 3.74Å; H262-H284 PolarHBondContact N-O 3.46Å; H262-H285 WeakPolarHBondContact CA-O 3.35Å; H262-H285 WeakPolarHBondContact CD2-CB 3.31Å; H262-H285 AromaticContact CD2-CG 3.56Å; H262-H285 AromaticContact CD2-ND1 3.93Å; H262-H285 AromaticContact CE1-ND1 3.98Å; H262-H285 PolarHBondContact N-O 3.23Å; H262-H285 AromaticContact NE2-CE1 3.9Å; H262-H285 AromaticContact NE2-CG 3.44Å; H262-H285 AromaticContact NE2-ND1 3.33Å; H262-H285 PolarHBondContact NE2-ND1 2.86Å
263	N	97.9	Very high	94.6	Very high	10 Å²	10	29 Å²	29	5%	0.053	15%	0.154	C	C	.	.	S	Bend	trans	-93.9	-173.6	172.5	-72.8	-69.6	0	0	0	111.1	M236 S239 Q240 I241 L260 A261 L265 N286	M236-N263 PolarHBondContact O-ND2 3.23Å; S239-N263 WeakPolarHBondContact CA-OD1 3.44Å; S239-N263 PolarHBondContact N-OD1 3.05Å; Q240-N263 PolarHBondContact N-OD1 2.98Å; I241-N263 HydrophobicContact CB-CB 4.14Å; I241-N263 PolarHBondContact N-OD1 3.05Å; L260-N263 VanDerWaalsContact C-ND2 3.3Å; L260-N263 PolarHBondContact O-ND2 3.13Å; A261-N263 PolarHBondContact O-N 2.9Å; A261-N263 PolarHBondContact O-ND2 3Å; N263-L265 HydrophobicContact CB-CD1 4.43Å; N263-L265 HydrophobicContact CB-CG 4.27Å; N263-N286 VanDerWaalsContact CA-OD1 3.29Å; N263-N286 WeakPolarHBondContact CA-OD1 3.36Å; N263-N286 WeakPolarHBondContact CB-OD1 3.15Å; N263-N286 PolarHBondContact N-OD1 2.87Å; N263-N286 PolarHBondContact O-OD1 3.32Å; N263-N286 VanDerWaalsContact O-OD1 3.05Å
264	N	97.3	Very high	94.6	Very high	84 Å²	84	27 Å²	27	45%	0.449	15%	0.15	S	C	.	.			trans	-110	32.4	179.7	-163.7	77	0	0	0	111.5	I241 Q242 T266	I241-N264 CarbonylContact O-C 3.26Å; I241-N264 VanDerWaalsContact O-C 3.29Å; I241-N264 WeakPolarHBondContact O-CA 3.35Å; I241-N264 PolarHBondContact O-N 2.8Å; Q242-N264 HydrophobicContact CG-CB 4.29Å; N264-T266 PolarHBondContact O-N 2.9Å
265	L	96.5	Very high	94.3	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.156	C	C	.	.			trans	-71.3	125.1	179	-64.3	166.3	0	0	0	110.5	I241 I244 L260 N263 L268 N286 P287 W288	I241-L265 HydrophobicContact CB-CD2 4.45Å; I241-L265 HydrophobicContact CG2-CD2 3.76Å; I241-L265 HydrophobicContact CG2-CG 4.47Å; I241-L265 PolarHBondContact O-N 3.01Å; I244-L265 HydrophobicContact CD1-CD1 4.03Å; I244-L265 HydrophobicContact CD1-CD2 3.88Å; I244-L265 HydrophobicContact CG1-CD2 4.02Å; L260-L265 HydrophobicContact CB-CD1 4.08Å; L260-L265 HydrophobicContact CD1-CD1 4.32Å; L260-L265 HydrophobicContact CD2-CD1 4.32Å; L260-L265 HydrophobicContact CG-CD1 4.49Å; N263-L265 HydrophobicContact CB-CD1 4.43Å; N263-L265 HydrophobicContact CB-CG 4.27Å; L265-L268 HydrophobicContact CD1-CD2 4.34Å; L265-L268 HydrophobicContact CD2-CD2 4.4Å; L265-N286 HydrophobicContact CB-CB 4.26Å; L265-N286 WeakPolarHBondContact CB-OD1 3.34Å; L265-N286 PolarHBondContact N-OD1 2.6Å; L265-N286 VanDerWaalsContact N-OD1 3.15Å; L265-P287 CarbonylContact O-C 3.56Å; L265-P287 WeakPolarHBondContact O-CD 3.26Å; L265-W288 HydrophobicContact CB-CH2 3.55Å; L265-W288 HydrophobicContact CB-CZ2 4.2Å; L265-W288 HydrophobicContact CB-CZ3 3.84Å; L265-W288 HydrophobicContact CD1-CH2 3.96Å; L265-W288 HydrophobicContact CD1-CZ2 4.48Å; L265-W288 HydrophobicContact CG-CH2 4.38Å
266	T	95.6	Very high	94.1	Very high	64 Å²	64	28.8 Å²	28.8	39%	0.393	16%	0.16	S	C	.	.			trans	-95.7	-37.6	173.3	54.2	0	0	0	0	111.9	N264 P287 W288 N289	N264-T266 PolarHBondContact O-N 2.9Å; T266-P287 HydrophobicContact CG2-CG 4.18Å; T266-W288 CarbonylContact O-C 3.36Å; T266-W288 WeakPolarHBondContact O-CA 3.47Å; T266-N289 PolarHBondContact O-N 2.75Å
267	L	94.1	Very high	93.8	Very high	19 Å²	19	37 Å²	37	10%	0.099	19%	0.187	C	C	.	.			trans	-147.2	166.7	-177.1	-77.8	168.5	0	0	0	109.9	N289 D293 I294 L366	L267-N289 WeakPolarHBondContact CD2-O 3.4Å; L267-N289 HydrophobicContact CG-CB 4.3Å; L267-D293 HydrophobicContact CD1-CB 4.44Å; L267-D293 HydrophobicContact CD2-CB 4.04Å; L267-I294 HydrophobicContact CD2-CD1 3.95Å; L267-L366 HydrophobicContact CB-CD1 3.56Å; L267-L366 HydrophobicContact CB-CD2 3.97Å; L267-L366 HydrophobicContact CB-CG 4.44Å; L267-L366 HydrophobicContact CD1-CD1 3.31Å; L267-L366 HydrophobicContact CG-CD1 3.93Å
268	L	95.3	Very high	93.5	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.185	C	C	.	.			trans	-127.9	143.5	173.4	-67.4	178.8	0	0	0	109.8	I244 L265 L272 F273 L283 W288 W296 L297	I244-L268 HydrophobicContact CD1-CD2 3.72Å; L265-L268 HydrophobicContact CD1-CD2 4.34Å; L265-L268 HydrophobicContact CD2-CD2 4.4Å; L268-L272 HydrophobicContact CB-CD2 4.24Å; L268-L272 HydrophobicContact CD1-CD2 4.38Å; L268-L272 HydrophobicContact CD2-CD2 3.99Å; L268-L272 HydrophobicContact CG-CD2 4.44Å; L268-F273 HydrophobicContact CD1-CE2 3.56Å; L268-F273 HydrophobicContact CD1-CZ 3.58Å; L268-L283 HydrophobicContact CD1-CD2 4.19Å; L268-W288 HydrophobicContact CD1-CH2 4.1Å; L268-W288 HydrophobicContact CD1-CZ3 4.42Å; L268-W288 HydrophobicContact CD2-CH2 4.19Å; L268-W288 HydrophobicContact CD2-CZ3 4.41Å; L268-W288 HydrophobicContact CG-CH2 3.88Å; L268-W288 HydrophobicContact CG-CZ3 3.86Å; L268-W296 HydrophobicContact CB-CZ2 3.84Å; L268-L297 HydrophobicContact CD1-CD1 4.49Å; L268-L297 HydrophobicContact CD1-CD2 4.17Å
269	P	94.6	Very high	93.1	Very high	4 Å²	4	42 Å²	42	3%	0.026	21%	0.211	C	C	.	.			trans	-52	146	170.5	-26.6	32.7	0	0	0	113	I244 R246 L272 W296 L366	I244-P269 VanDerWaalsContact O-CD 3.31Å; I244-P269 WeakPolarHBondContact O-CD 3.31Å; I244-P269 WeakPolarHBondContact O-CG 3.38Å; R246-P269 HydrophobicContact CG-CB 4.49Å; P269-L272 WeakPolarHBondContact O-CB 3.25Å; P269-L272 PolarHBondContact O-N 2.92Å; P269-W296 WeakPolarHBondContact O-CZ2 3.44Å; P269-L366 WeakPolarHBondContact CA-O 3.3Å
270	H	93.8	Very high	92.7	Very high	27 Å²	27	46.9 Å²	46.9	13%	0.125	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	142.6	175.8	-165.6	-95.8	0	0	0	111.8	L272 W296 L366 S368 N415 S416	H270-L272 PolarHBondContact O-N 3.19Å; H270-W296 AromaticContact CD2-CD1 3.59Å; H270-W296 AromaticContact CD2-CG 3.7Å; H270-L366 WeakPolarHBondContact CB-O 3.07Å; H270-L366 PolarHBondContact N-O 2.87Å; H270-S368 PolarHBondContact ND1-OG 3.17Å; H270-S368 VanDerWaalsContact ND1-OG 3.08Å; H270-N415 PolarHBondContact NE2-O 2.84Å; H270-S416 PolarHBondContact CD2-N 2.81Å; H270-S416 WeakPolarHBondContact NE2-CA 3.11Å; H270-S416 PolarHBondContact NE2-N 3.11Å; H270-S416 VanDerWaalsContact NE2-N 3.2Å
271	D	91.4	Very high	92.4	Very high	64 Å²	64	47 Å²	47	34%	0.342	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	13.9	-179.9	-76.8	-48.1	0	0	0	116.9	F273 T274 P275	D271-F273 PolarHBondContact O-N 2.87Å; D271-T274 WeakPolarHBondContact CA-OG1 3.24Å; D271-T274 WeakPolarHBondContact O-CB 3.29Å; D271-T274 PolarHBondContact O-N 3.12Å; D271-T274 WeakPolarHBondContact OD1-CB 3.35Å; D271-T274 PolarHBondContact OD1-OG1 3.26Å; D271-P275 VanDerWaalsContact O-CD 3.23Å; D271-P275 WeakPolarHBondContact O-CD 3.48Å
272	L	93.8	Very high	92.3	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.016	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.6	-175.9	-179.3	68.6	0	0	0	114.6	I244 F249 L268 P269 H270 W296	I244-L272 HydrophobicContact CG2-CD1 4.15Å; I244-L272 HydrophobicContact CG2-CD2 3.92Å; F249-L272 HydrophobicContact CD2-CD1 3.76Å; F249-L272 HydrophobicContact CD2-CD2 4.03Å; F249-L272 HydrophobicContact CD2-CG 3.84Å; F249-L272 HydrophobicContact CE2-CD1 4.33Å; F249-L272 HydrophobicContact CE2-CD2 3.91Å; F249-L272 HydrophobicContact CE2-CG 4.25Å; F249-L272 HydrophobicContact CG-CD1 4.47Å; L268-L272 HydrophobicContact CB-CD2 4.24Å; L268-L272 HydrophobicContact CD1-CD2 4.38Å; L268-L272 HydrophobicContact CD2-CD2 3.99Å; L268-L272 HydrophobicContact CG-CD2 4.44Å; P269-L272 WeakPolarHBondContact O-CB 3.25Å; P269-L272 PolarHBondContact O-N 2.92Å; H270-L272 PolarHBondContact O-N 3.19Å; L272-W296 HydrophobicContact CB-CH2 3.95Å; L272-W296 HydrophobicContact CB-CZ2 4.19Å
273	F	92.1	Very high	92.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-3.2	178	-53.9	-42	0	0	0	113.9	F249 L260 L268 D271 L276 L278 I281 L283 W296 L297 W300	F249-F273 HydrophobicContact CD2-CE1 4.14Å; F249-F273 HydrophobicContact CE2-CE1 4.16Å; L260-F273 HydrophobicContact CD1-CZ 4.5Å; L268-F273 HydrophobicContact CD1-CE2 3.56Å; L268-F273 HydrophobicContact CD1-CZ 3.58Å; D271-F273 PolarHBondContact O-N 2.87Å; F273-L276 HydrophobicContact CD1-CD1 4.17Å; F273-L276 PolarHBondContact O-N 2.97Å; F273-L278 HydrophobicContact CB-CD1 4.21Å; F273-L278 HydrophobicContact CD1-CD1 3.84Å; F273-L278 HydrophobicContact CE1-CD1 4.47Å; F273-L278 HydrophobicContact CG-CD1 4.09Å; F273-I281 HydrophobicContact CD2-CD1 3.78Å; F273-I281 HydrophobicContact CE1-CD1 4.24Å; F273-I281 HydrophobicContact CE2-CD1 3.31Å; F273-I281 HydrophobicContact CG-CD1 4.43Å; F273-I281 HydrophobicContact CZ-CD1 3.58Å; F273-L283 HydrophobicContact CE2-CD1 4.37Å; F273-W296 HydrophobicContact CB-CH2 4.44Å; F273-W296 HydrophobicContact CB-CZ3 4.24Å; F273-W296 AromaticContact CD2-CH2 3.56Å; F273-W296 HydrophobicContact CD2-CH2 3.56Å; F273-W296 AromaticContact CD2-CZ3 3.9Å; F273-W296 HydrophobicContact CD2-CZ3 3.9Å; F273-W296 AromaticContact CE2-CH2 3.99Å; F273-W296 HydrophobicContact CE2-CH2 3.99Å; F273-W296 HydrophobicContact CG-CH2 4.11Å; F273-W296 HydrophobicContact CG-CZ3 4.36Å; F273-L297 HydrophobicContact CD2-CD1 3.99Å; F273-L297 HydrophobicContact CE2-CD1 3.81Å; F273-W300 HydrophobicContact CB-CD2 4.3Å; F273-W300 HydrophobicContact CB-CZ2 4.02Å; F273-W300 PolarHBondContact O-NE1 2.91Å
274	T	89.3	Confident	91.9	Very high	81 Å²	81	45.9 Å²	45.9	50%	0.497	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-34	-179.7	-57.4	0	0	0	0	114.3	D271 L276	D271-T274 WeakPolarHBondContact CA-OG1 3.24Å; D271-T274 WeakPolarHBondContact O-CB 3.29Å; D271-T274 PolarHBondContact O-N 3.12Å; D271-T274 WeakPolarHBondContact OD1-CB 3.35Å; D271-T274 PolarHBondContact OD1-OG1 3.26Å; T274-L276 VanDerWaalsContact C-N 3.28Å; T274-L276 PolarHBondContact O-N 2.83Å
275	P	89	Confident	91.8	Very high	69 Å²	69	48.1 Å²	48.1	45%	0.448	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.2	173.5	31.6	-34.5	0	0	0	114.1	D271	D271-P275 VanDerWaalsContact O-CD 3.23Å; D271-P275 WeakPolarHBondContact O-CD 3.48Å
276	L	90.4	Very high	91.8	Very high	15 Å²	15	48.6 Å²	48.6	8%	0.079	23%	0.233	C	C	.	.	S	Bend	trans	-103.7	151.9	-170.5	-51	-177.8	0	0	0	112.5	F249 L255 F273 T274 L278	F249-L276 HydrophobicContact CB-CD1 3.92Å; L255-L276 HydrophobicContact CD2-CD1 4.41Å; F273-L276 HydrophobicContact CD1-CD1 4.17Å; F273-L276 PolarHBondContact O-N 2.97Å; T274-L276 VanDerWaalsContact C-N 3.28Å; T274-L276 PolarHBondContact O-N 2.83Å; L276-L278 HydrophobicContact CB-CD1 4.32Å; L276-L278 HydrophobicContact CB-CG 4.05Å; L276-L278 HydrophobicContact CD1-CD1 4.05Å; L276-L278 HydrophobicContact CD1-CG 4.39Å; L276-L278 PolarHBondContact O-N 3.47Å
277	R	86.8	Confident	91.9	Very high	210 Å²	210	47 Å²	47	79%	0.792	22%	0.224	S	C	*	.			trans	-101.3	44.7	178	-63	-176.9	-179.9	178.7	1.5	112.1	L255 E279	L255-R277 CarbonylContact O-C 3.58Å; L255-R277 VanDerWaalsContact O-C 3.26Å; R277-E279 PolarHBondContact O-N 3.27Å
278	L	87.8	Confident	92	Very high	12 Å²	12	46.1 Å²	46.1	6%	0.063	22%	0.219	C	C	.	.			trans	-66	125.3	-178.9	-71	169.9	0	0	0	111.5	L255 I258 F273 L276 W300	L255-L278 HydrophobicContact CB-CD2 4.31Å; L255-L278 HydrophobicContact CD2-CD2 3.97Å; L255-L278 HydrophobicContact CG-CD2 3.88Å; L255-L278 PolarHBondContact O-N 2.79Å; I258-L278 HydrophobicContact CB-CD2 4.02Å; I258-L278 HydrophobicContact CG2-CD1 3.73Å; I258-L278 HydrophobicContact CG2-CD2 3.78Å; I258-L278 HydrophobicContact CG2-CG 4.43Å; F273-L278 HydrophobicContact CB-CD1 4.21Å; F273-L278 HydrophobicContact CD1-CD1 3.84Å; F273-L278 HydrophobicContact CE1-CD1 4.47Å; F273-L278 HydrophobicContact CG-CD1 4.09Å; L276-L278 HydrophobicContact CB-CD1 4.32Å; L276-L278 HydrophobicContact CB-CG 4.05Å; L276-L278 HydrophobicContact CD1-CD1 4.05Å; L276-L278 HydrophobicContact CD1-CG 4.39Å; L276-L278 PolarHBondContact O-N 3.47Å; L278-W300 HydrophobicContact CB-CH2 3.93Å; L278-W300 HydrophobicContact CB-CZ2 3.96Å; L278-W300 HydrophobicContact CD1-CH2 4.43Å; L278-W300 HydrophobicContact CD1-CZ2 4.33Å
279	E	86.3	Confident	92.1	Very high	119 Å²	119	48.3 Å²	48.3	56%	0.556	23%	0.231	S	C	*	.	S	Bend	trans	-92.5	-25.8	166.4	-65.8	179.6	-174.9	0	0	111.7	V256 R277	V256-E279 HydrophobicContact CG1-CB 3.85Å; V256-E279 HydrophobicContact CG1-CG 3.85Å; V256-E279 PolarHBondContact O-N 3.12Å; R277-E279 PolarHBondContact O-N 3.27Å
280	R	87.8	Confident	92.1	Very high	117 Å²	117	48.2 Å²	48.2	44%	0.442	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.1	-171.5	-62.7	177	-163.8	165.4	5.3	111.6	V256 E257 I258	V256-R280 PolarHBondContact O-N 3.44Å; E257-R280 WeakPolarHBondContact CA-O 3.39Å; E257-R280 HydrophobicContact CB-CB 4.13Å; E257-R280 HydrophobicContact CG-CB 3.87Å; E257-R280 WeakPolarHBondContact OE2-CD 3.41Å; E257-R280 IonicContact OE2-CZ 3.27Å; E257-R280 IonicContact OE2-NE 2.77Å; E257-R280 IonicContact OE2-NH1 2.79Å; E257-R280 PolarHBondContact OE2-NH1 2.93Å; I258-R280 PolarHBondContact N-O 3.02Å; I258-R280 VanDerWaalsContact N-O 3.13Å
281	I	89.6	Confident	92.1	Very high	3 Å²	3	49 Å²	49	2%	0.015	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138.3	180	-175.9	159.5	0	0	0	110.7	I258 F273 L283 W300 C311	I258-I281 HydrophobicContact CG2-CB 4.29Å; I258-I281 HydrophobicContact CG2-CD1 4.04Å; I258-I281 HydrophobicContact CG2-CG1 3.89Å; I258-I281 WeakPolarHBondContact O-CA 3.08Å; F273-I281 HydrophobicContact CD2-CD1 3.78Å; F273-I281 HydrophobicContact CE1-CD1 4.24Å; F273-I281 HydrophobicContact CE2-CD1 3.31Å; F273-I281 HydrophobicContact CG-CD1 4.43Å; F273-I281 HydrophobicContact CZ-CD1 3.58Å; I281-L283 HydrophobicContact CD1-CD1 3.67Å; I281-L283 HydrophobicContact CD1-CD2 4.42Å; I281-L283 HydrophobicContact CD1-CG 3.96Å; I281-L283 HydrophobicContact CG1-CD1 3.97Å; I281-L283 HydrophobicContact CG1-CG 3.82Å; I281-W300 HydrophobicContact CG2-CH2 4.29Å; I281-W300 HydrophobicContact CG2-CZ3 3.78Å; I281-C311 HydrophobicContact CG2-CB 4.33Å; I281-C311 VanDerWaalsContact O-CB 3.26Å; I281-C311 WeakPolarHBondContact O-CB 3.07Å
282	H	92.6	Very high	92.1	Very high	30 Å²	30	47.5 Å²	47.5	14%	0.139	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	104.7	176.6	-57.2	-97.9	0	0	0	110.3	I258 N259 L260 A261	I258-H282 PolarHBondContact O-N 3.02Å; N259-H282 HydrophobicContact CB-CB 4.18Å; N259-H282 VanDerWaalsContact CG-CB 3.5Å; N259-H282 VanDerWaalsContact OD1-CB 3.31Å; N259-H282 WeakPolarHBondContact OD1-CB 3.19Å; L260-H282 CarbonylContact C-O 3.22Å; L260-H282 PolarHBondContact N-O 3.39Å; A261-H282 PolarHBondContact N-O 2.83Å
283	L	93.3	Very high	92.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.235	C	C	.	.			trans	-114.2	5	-179.5	-69.8	168.1	0	0	0	113	L260 L268 F273 I281 N286 W288 L297 A313	L260-L283 HydrophobicContact CB-CD2 4.06Å; L260-L283 HydrophobicContact CD1-CD2 4.05Å; L268-L283 HydrophobicContact CD1-CD2 4.19Å; F273-L283 HydrophobicContact CE2-CD1 4.37Å; I281-L283 HydrophobicContact CD1-CD1 3.67Å; I281-L283 HydrophobicContact CD1-CD2 4.42Å; I281-L283 HydrophobicContact CD1-CG 3.96Å; I281-L283 HydrophobicContact CG1-CD1 3.97Å; I281-L283 HydrophobicContact CG1-CG 3.82Å; L283-N286 PolarHBondContact O-ND2 2.97Å; L283-N286 VanDerWaalsContact O-ND2 3.12Å; L283-W288 HydrophobicContact CB-CZ2 3.79Å; L283-W288 HydrophobicContact CD2-CH2 3.91Å; L283-W288 HydrophobicContact CD2-CZ2 3.62Å; L283-W288 HydrophobicContact CG-CZ2 4.16Å; L283-W288 PolarHBondContact O-NE1 3.48Å; L283-L297 HydrophobicContact CD1-CD1 3.99Å; L283-L297 HydrophobicContact CD1-CD2 4.14Å; L283-A313 HydrophobicContact CB-CB 3.86Å
284	H	92.8	Very high	92.1	Very high	41 Å²	41	48.6 Å²	48.6	19%	0.19	24%	0.235	C	C	.	.			trans	-67.1	156.3	-176.9	65.7	45.1	0	0	0	112.9	A261 H262 C312	A261-H284 WeakPolarHBondContact CA-O 3.29Å; A261-H284 WeakPolarHBondContact CB-CE1 3.27Å; A261-H284 WeakPolarHBondContact CB-ND1 3.32Å; H262-H284 AromaticContact CE1-CE1 3.74Å; H262-H284 PolarHBondContact N-O 3.46Å; H284-C312 HydrophobicContact CB-CB 4.27Å
285	H	95.6	Very high	92.3	Very high	132 Å²	132	44.8 Å²	44.8	61%	0.611	21%	0.211	S	C	*	.	S	Bend	trans	57.9	46.1	-177.3	-59.5	95.8	0	0	0	113.4	H262	H262-H285 WeakPolarHBondContact CA-O 3.35Å; H262-H285 WeakPolarHBondContact CD2-CB 3.31Å; H262-H285 AromaticContact CD2-CG 3.56Å; H262-H285 AromaticContact CD2-ND1 3.93Å; H262-H285 AromaticContact CE1-ND1 3.98Å; H262-H285 PolarHBondContact N-O 3.23Å; H262-H285 AromaticContact NE2-CE1 3.9Å; H262-H285 AromaticContact NE2-CG 3.44Å; H262-H285 AromaticContact NE2-ND1 3.33Å; H262-H285 PolarHBondContact NE2-ND1 2.86Å
286	N	96.9	Very high	92.5	Very high	10 Å²	10	42.1 Å²	42.1	5%	0.053	19%	0.192	C	C	.	.	S	Bend	trans	-123.1	148.6	166.8	-79.4	-81	0	0	0	108.8	L260 N263 L265 L283 W288	L260-N286 PolarHBondContact O-ND2 3.47Å; N263-N286 VanDerWaalsContact CA-OD1 3.29Å; N263-N286 WeakPolarHBondContact CA-OD1 3.36Å; N263-N286 WeakPolarHBondContact CB-OD1 3.15Å; N263-N286 PolarHBondContact N-OD1 2.87Å; N263-N286 PolarHBondContact O-OD1 3.32Å; N263-N286 VanDerWaalsContact O-OD1 3.05Å; L265-N286 HydrophobicContact CB-CB 4.26Å; L265-N286 WeakPolarHBondContact CB-OD1 3.34Å; L265-N286 PolarHBondContact N-OD1 2.6Å; L265-N286 VanDerWaalsContact N-OD1 3.15Å; L283-N286 PolarHBondContact O-ND2 2.97Å; L283-N286 VanDerWaalsContact O-ND2 3.12Å; N286-W288 HydrophobicContact CB-CD2 4.19Å; N286-W288 HydrophobicContact CB-CG 4.46Å; N286-W288 HydrophobicContact CB-CH2 4.47Å; N286-W288 HydrophobicContact CB-CZ2 3.65Å; N286-W288 PolarHBondContact O-N 2.94Å
287	P	97	Very high	92.6	Very high	30 Å²	30	41.4 Å²	41.4	20%	0.195	19%	0.189	C	C	.	.			trans	-78.3	57.2	-178.7	34.2	-38.3	0	0	0	113.3	L265 T266 N289 H316	L265-P287 CarbonylContact O-C 3.56Å; L265-P287 WeakPolarHBondContact O-CD 3.26Å; T266-P287 HydrophobicContact CG2-CG 4.18Å; P287-N289 PolarHBondContact O-N 3.02Å; P287-H316 HydrophobicContact CB-CB 4.33Å
288	W	96.8	Very high	92.9	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	128.4	-174.2	-64.1	113.9	0	0	0	113.9	L265 T266 L268 L283 N286 I294 H316 T317 I326	L265-W288 HydrophobicContact CB-CH2 3.55Å; L265-W288 HydrophobicContact CB-CZ2 4.2Å; L265-W288 HydrophobicContact CB-CZ3 3.84Å; L265-W288 HydrophobicContact CD1-CH2 3.96Å; L265-W288 HydrophobicContact CD1-CZ2 4.48Å; L265-W288 HydrophobicContact CG-CH2 4.38Å; T266-W288 CarbonylContact O-C 3.36Å; T266-W288 WeakPolarHBondContact O-CA 3.47Å; L268-W288 HydrophobicContact CD1-CH2 4.1Å; L268-W288 HydrophobicContact CD1-CZ3 4.42Å; L268-W288 HydrophobicContact CD2-CH2 4.19Å; L268-W288 HydrophobicContact CD2-CZ3 4.41Å; L268-W288 HydrophobicContact CG-CH2 3.88Å; L268-W288 HydrophobicContact CG-CZ3 3.86Å; L283-W288 HydrophobicContact CB-CZ2 3.79Å; L283-W288 HydrophobicContact CD2-CH2 3.91Å; L283-W288 HydrophobicContact CD2-CZ2 3.62Å; L283-W288 HydrophobicContact CG-CZ2 4.16Å; L283-W288 PolarHBondContact O-NE1 3.48Å; N286-W288 HydrophobicContact CB-CD2 4.19Å; N286-W288 HydrophobicContact CB-CG 4.46Å; N286-W288 HydrophobicContact CB-CH2 4.47Å; N286-W288 HydrophobicContact CB-CZ2 3.65Å; N286-W288 PolarHBondContact O-N 2.94Å; W288-I294 HydrophobicContact CE3-CD1 4.12Å; W288-H316 PolarHBondContact O-N 2.72Å; W288-T317 PolarHBondContact O-N 2.78Å; W288-I326 HydrophobicContact CB-CD1 3.84Å; W288-I326 HydrophobicContact CD2-CD1 4.09Å; W288-I326 HydrophobicContact CG-CD1 3.57Å
289	N	96.1	Very high	93	Very high	47 Å²	47	36 Å²	36	25%	0.251	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	99.3	174.1	-176.8	49.4	0	0	0	109.7	T266 L267 P287 N291 T317	T266-N289 PolarHBondContact O-N 2.75Å; L267-N289 WeakPolarHBondContact CD2-O 3.4Å; L267-N289 HydrophobicContact CG-CB 4.3Å; P287-N289 PolarHBondContact O-N 3.02Å; N289-N291 PolarHBondContact O-N 2.8Å; N289-T317 WeakPolarHBondContact CA-OG1 3.33Å; N289-T317 WeakPolarHBondContact CB-OG1 3.48Å; N289-T317 WeakPolarHBondContact OD1-CB 3.45Å; N289-T317 PolarHBondContact OD1-OG1 3.17Å
290	C	95.3	Very high	93.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.007	15%	0.146	C	C	.	.			trans	-80.2	91.9	-176.9	-66.1	0	0	0	0	111	I294 C315 T317 P318 L321 L329 F334	C290-I294 HydrophobicContact CB-CG2 4.18Å; C290-C315 HydrophobicContact CB-CB 3.84Å; C290-C315 WeakPolarHBondContact CB-SG 3.32Å; C290-C315 VanDerWaalsContact SG-CA 3.51Å; C290-C315 WeakPolarHBondContact SG-CB 3.49Å; C290-C315 CovalentContact SG-SG 2.03Å; C290-C315 PolarHBondContact SG-SG 3.38Å; C290-T317 PolarHBondContact N-O 2.89Å; C290-P318 WeakPolarHBondContact O-CD 3.25Å; C290-L321 HydrophobicContact CB-CD1 4.03Å; C290-L329 HydrophobicContact CB-CD1 3.94Å; C290-F334 WeakPolarHBondContact O-CE1 3.23Å
291	N	93.3	Very high	93.3	Very high	45 Å²	45	26.2 Å²	26.2	24%	0.241	13%	0.126	C	C	.	.	S	Bend	trans	-121.2	-167.2	169.8	72.9	-14.4	0	0	0	109.8	N289 D293 I294	N289-N291 PolarHBondContact O-N 2.8Å; N291-D293 PolarHBondContact ND2-OD2 3.29Å; N291-D293 PolarHBondContact O-N 2.99Å; N291-D293 VanDerWaalsContact O-N 3.14Å; N291-D293 WeakPolarHBondContact OD1-CB 3.4Å; N291-D293 PolarHBondContact OD1-N 3.02Å; N291-D293 PolarHBondContact OD1-OD2 2.82Å; N291-I294 VanDerWaalsContact O-CG2 3.32Å; N291-I294 WeakPolarHBondContact O-CG2 3.21Å; N291-I294 PolarHBondContact O-N 2.92Å; N291-I294 VanDerWaalsContact O-N 3.09Å
292	C	92.4	Very high	93.1	Very high	31 Å²	31	33.8 Å²	33.8	21%	0.209	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-53.5	-31.5	175.5	-63.6	0	0	0	0	114.6	I294 L295 C336 S416	C292-I294 PolarHBondContact O-N 2.89Å; C292-L295 WeakPolarHBondContact O-CB 3.39Å; C292-L295 PolarHBondContact O-N 2.99Å; C292-C336 VanDerWaalsContact CA-SG 3.59Å; C292-C336 HydrophobicContact CB-CB 3.78Å; C292-C336 WeakPolarHBondContact CB-SG 3.27Å; C292-C336 WeakPolarHBondContact SG-CA 3.21Å; C292-C336 WeakPolarHBondContact SG-CB 3.25Å; C292-C336 CovalentContact SG-SG 2.03Å; C292-C336 PolarHBondContact SG-SG 3.31Å; C292-S416 PolarHBondContact O-OG 3.18Å
293	D	92.9	Very high	92.8	Very high	26 Å²	26	37.9 Å²	37.9	14%	0.139	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-71.5	-16.6	-178.3	-52.8	-55.9	0	0	0	112.5	L267 N291 W296 L366	L267-D293 HydrophobicContact CD1-CB 4.44Å; L267-D293 HydrophobicContact CD2-CB 4.04Å; N291-D293 PolarHBondContact ND2-OD2 3.29Å; N291-D293 PolarHBondContact O-N 2.99Å; N291-D293 VanDerWaalsContact O-N 3.14Å; N291-D293 WeakPolarHBondContact OD1-CB 3.4Å; N291-D293 PolarHBondContact OD1-N 3.02Å; N291-D293 PolarHBondContact OD1-OD2 2.82Å; D293-W296 PolarHBondContact O-NE1 3.25Å; D293-L366 HydrophobicContact CB-CD1 4.12Å
294	I	93.1	Very high	92.2	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-82.9	-12.7	176.2	-145	73	0	0	0	113.3	L267 W288 C290 N291 C292 W296 L297 S298 I326 L329	L267-I294 HydrophobicContact CD2-CD1 3.95Å; W288-I294 HydrophobicContact CE3-CD1 4.12Å; C290-I294 HydrophobicContact CB-CG2 4.18Å; N291-I294 VanDerWaalsContact O-CG2 3.32Å; N291-I294 WeakPolarHBondContact O-CG2 3.21Å; N291-I294 PolarHBondContact O-N 2.92Å; N291-I294 VanDerWaalsContact O-N 3.09Å; C292-I294 PolarHBondContact O-N 2.89Å; I294-W296 PolarHBondContact O-N 2.9Å; I294-L297 HydrophobicContact CD1-CD2 3.9Å; I294-L297 HydrophobicContact CG1-CD2 4.34Å; I294-L297 WeakPolarHBondContact O-CB 3.29Å; I294-L297 PolarHBondContact O-N 3.48Å; I294-L297 VanDerWaalsContact O-N 3.11Å; I294-S298 PolarHBondContact O-N 3.05Å; I294-I326 HydrophobicContact CD1-CD1 4.37Å; I294-I326 HydrophobicContact CG1-CD1 4.22Å; I294-I326 HydrophobicContact CG1-CG2 3.92Å; I294-L329 HydrophobicContact CG2-CD1 3.68Å
295	L	92.8	Very high	91.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-40.4	-169.6	-78	171.4	0	0	0	113.2	C292 L297 S298 W299 L331 F334	C292-L295 WeakPolarHBondContact O-CB 3.39Å; C292-L295 PolarHBondContact O-N 2.99Å; L295-L297 PolarHBondContact O-N 3.18Å; L295-S298 WeakPolarHBondContact O-CB 3.24Å; L295-S298 PolarHBondContact O-N 3.39Å; L295-S298 VanDerWaalsContact O-N 3.17Å; L295-W299 HydrophobicContact CB-CH2 4.04Å; L295-W299 HydrophobicContact CB-CZ2 3.87Å; L295-W299 HydrophobicContact CB-CZ3 4.49Å; L295-W299 HydrophobicContact CD1-CZ2 4.35Å; L295-W299 HydrophobicContact CD2-CZ2 4.18Å; L295-W299 HydrophobicContact CG-CZ2 4.37Å; L295-W299 VanDerWaalsContact O-CD2 3.26Å; L295-W299 VanDerWaalsContact O-CG 3.27Å; L295-W299 PolarHBondContact O-N 2.94Å; L295-L331 HydrophobicContact CD1-CD1 3.7Å; L295-F334 HydrophobicContact CD1-CD2 4.14Å; L295-F334 HydrophobicContact CD2-CD2 3.84Å; L295-F334 HydrophobicContact CD2-CE2 3.82Å; L295-F334 HydrophobicContact CG-CD2 4.16Å; L295-F334 HydrophobicContact CG-CE2 4.31Å
296	W	93.1	Very high	89.5	Confident	13 Å²	13	39.5 Å²	39.5	5%	0.049	20%	0.197	C	C	.	.	H	α-helix	trans	-58.7	-38.8	175.8	78.6	-94.1	0	0	0	111.3	L268 P269 H270 L272 F273 D293 I294 W299 W300	L268-W296 HydrophobicContact CB-CZ2 3.84Å; P269-W296 WeakPolarHBondContact O-CZ2 3.44Å; H270-W296 AromaticContact CD2-CD1 3.59Å; H270-W296 AromaticContact CD2-CG 3.7Å; L272-W296 HydrophobicContact CB-CH2 3.95Å; L272-W296 HydrophobicContact CB-CZ2 4.19Å; F273-W296 HydrophobicContact CB-CH2 4.44Å; F273-W296 HydrophobicContact CB-CZ3 4.24Å; F273-W296 AromaticContact CD2-CH2 3.56Å; F273-W296 HydrophobicContact CD2-CH2 3.56Å; F273-W296 AromaticContact CD2-CZ3 3.9Å; F273-W296 HydrophobicContact CD2-CZ3 3.9Å; F273-W296 AromaticContact CE2-CH2 3.99Å; F273-W296 HydrophobicContact CE2-CH2 3.99Å; F273-W296 HydrophobicContact CG-CH2 4.11Å; F273-W296 HydrophobicContact CG-CZ3 4.36Å; D293-W296 PolarHBondContact O-NE1 3.25Å; I294-W296 PolarHBondContact O-N 2.9Å; W296-W299 PolarHBondContact O-N 2.76Å; W296-W300 HydrophobicContact CE3-CB 4.37Å; W296-W300 HydrophobicContact CZ3-CB 4.42Å; W296-W300 HydrophobicContact CZ3-CG 4.45Å; W296-W300 VanDerWaalsContact O-CB 3.29Å; W296-W300 WeakPolarHBondContact O-CB 3.49Å; W296-W300 PolarHBondContact O-N 3.11Å
297	L	93	Very high	87.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-72.5	-36.4	178.9	-179.1	66	0	0	0	111.9	L268 F273 L283 I294 L295 I301 I326	L268-L297 HydrophobicContact CD1-CD1 4.49Å; L268-L297 HydrophobicContact CD1-CD2 4.17Å; F273-L297 HydrophobicContact CD2-CD1 3.99Å; F273-L297 HydrophobicContact CE2-CD1 3.81Å; L283-L297 HydrophobicContact CD1-CD1 3.99Å; L283-L297 HydrophobicContact CD1-CD2 4.14Å; I294-L297 HydrophobicContact CD1-CD2 3.9Å; I294-L297 HydrophobicContact CG1-CD2 4.34Å; I294-L297 WeakPolarHBondContact O-CB 3.29Å; I294-L297 PolarHBondContact O-N 3.48Å; I294-L297 VanDerWaalsContact O-N 3.11Å; L295-L297 PolarHBondContact O-N 3.18Å; L297-I301 HydrophobicContact CD1-CD1 4.16Å; L297-I301 HydrophobicContact CD1-CG1 4.31Å; L297-I301 HydrophobicContact CG-CD1 3.98Å; L297-I301 WeakPolarHBondContact O-CB 3.43Å; L297-I301 VanDerWaalsContact O-CG1 3.22Å; L297-I301 WeakPolarHBondContact O-CG1 3.32Å; L297-I301 PolarHBondContact O-N 3.06Å; L297-I326 HydrophobicContact CD2-CG2 4.46Å; L297-I326 HydrophobicContact CG-CG2 4.44Å
298	S	92.3	Very high	85.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.2	-51.1	170.6	174.6	0	0	0	0	110.8	I294 L295 I301 K302 I326 L329	I294-S298 PolarHBondContact O-N 3.05Å; L295-S298 WeakPolarHBondContact O-CB 3.24Å; L295-S298 PolarHBondContact O-N 3.39Å; L295-S298 VanDerWaalsContact O-N 3.17Å; S298-I301 PolarHBondContact O-N 3.25Å; S298-K302 WeakPolarHBondContact O-CB 3.37Å; S298-K302 PolarHBondContact O-N 2.89Å; S298-I326 WeakPolarHBondContact CB-O 3.42Å; S298-I326 PolarHBondContact OG-O 3.35Å; S298-L329 WeakPolarHBondContact CB-O 3.37Å; S298-L329 PolarHBondContact OG-O 3.33Å
299	W	90.5	Very high	83.9	Confident	108 Å²	108	52.3 Å²	52.3	41%	0.409	28%	0.276	S	S	.	.	H	α-helix	trans	-66.9	-40.8	-178.6	-54	-26.6	0	0	0	112.1	L295 W296 I301 K302 D303 S416	L295-W299 HydrophobicContact CB-CH2 4.04Å; L295-W299 HydrophobicContact CB-CZ2 3.87Å; L295-W299 HydrophobicContact CB-CZ3 4.49Å; L295-W299 HydrophobicContact CD1-CZ2 4.35Å; L295-W299 HydrophobicContact CD2-CZ2 4.18Å; L295-W299 HydrophobicContact CG-CZ2 4.37Å; L295-W299 VanDerWaalsContact O-CD2 3.26Å; L295-W299 VanDerWaalsContact O-CG 3.27Å; L295-W299 PolarHBondContact O-N 2.94Å; W296-W299 PolarHBondContact O-N 2.76Å; W299-I301 PolarHBondContact O-N 3.03Å; W299-K302 PolarHBondContact O-N 3.18Å; W299-D303 WeakPolarHBondContact O-CB 3.29Å; W299-D303 PolarHBondContact O-N 2.98Å; W299-S416 WeakPolarHBondContact CH2-O 3.5Å; W299-S416 VanDerWaalsContact CZ3-O 3.25Å; W299-S416 WeakPolarHBondContact CZ3-O 3.48Å
300	W	90.5	Very high	81.9	Confident	27 Å²	27	52.5 Å²	52.5	10%	0.102	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-46.2	173.6	-170.3	102.4	0	0	0	111.4	F273 L278 I281 W296 K302 D303 K304	F273-W300 HydrophobicContact CB-CD2 4.3Å; F273-W300 HydrophobicContact CB-CZ2 4.02Å; F273-W300 PolarHBondContact O-NE1 2.91Å; L278-W300 HydrophobicContact CB-CH2 3.93Å; L278-W300 HydrophobicContact CB-CZ2 3.96Å; L278-W300 HydrophobicContact CD1-CH2 4.43Å; L278-W300 HydrophobicContact CD1-CZ2 4.33Å; I281-W300 HydrophobicContact CG2-CH2 4.29Å; I281-W300 HydrophobicContact CG2-CZ3 3.78Å; W296-W300 HydrophobicContact CE3-CB 4.37Å; W296-W300 HydrophobicContact CZ3-CB 4.42Å; W296-W300 HydrophobicContact CZ3-CG 4.45Å; W296-W300 VanDerWaalsContact O-CB 3.29Å; W296-W300 WeakPolarHBondContact O-CB 3.49Å; W296-W300 PolarHBondContact O-N 3.11Å; W300-K302 PolarHBondContact O-N 2.86Å; W300-D303 PolarHBondContact O-N 3.03Å; W300-K304 HydrophobicContact CD2-CB 4.24Å; W300-K304 HydrophobicContact CD2-CG 4.43Å; W300-K304 HydrophobicContact CE3-CB 4.31Å; W300-K304 HydrophobicContact CH2-CB 4.11Å; W300-K304 HydrophobicContact CZ2-CB 4.08Å; W300-K304 HydrophobicContact CZ2-CG 4.44Å; W300-K304 HydrophobicContact CZ3-CB 4.23Å; W300-K304 WeakPolarHBondContact O-CB 2.97Å; W300-K304 PolarHBondContact O-N 3.2Å
301	I	89.1	Confident	80.2	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-45.1	175.8	-72.5	168.9	0	0	0	110.5	L297 S298 W299 D303 A305 Y325 I326	L297-I301 HydrophobicContact CD1-CD1 4.16Å; L297-I301 HydrophobicContact CD1-CG1 4.31Å; L297-I301 HydrophobicContact CG-CD1 3.98Å; L297-I301 WeakPolarHBondContact O-CB 3.43Å; L297-I301 VanDerWaalsContact O-CG1 3.22Å; L297-I301 WeakPolarHBondContact O-CG1 3.32Å; L297-I301 PolarHBondContact O-N 3.06Å; S298-I301 PolarHBondContact O-N 3.25Å; W299-I301 PolarHBondContact O-N 3.03Å; I301-D303 VanDerWaalsContact C-N 3.32Å; I301-D303 PolarHBondContact O-N 2.9Å; I301-A305 HydrophobicContact CG2-CB 4.15Å; I301-A305 VanDerWaalsContact O-CB 3.23Å; I301-A305 WeakPolarHBondContact O-CB 3.12Å; I301-A305 PolarHBondContact O-N 3.36Å; I301-Y325 HydrophobicContact CG2-CE1 4.29Å; I301-Y325 WeakPolarHBondContact CG2-OH 3.39Å; I301-I326 HydrophobicContact CD1-CB 4.46Å; I301-I326 HydrophobicContact CD1-CG2 4.19Å
302	K	86.6	Confident	79.2	Confident	162 Å²	162	53.4 Å²	53.4	70%	0.704	29%	0.293	S	S	*	.	H	α-helix	trans	-65.7	-30.5	-177.3	-174.7	175.7	178.6	179.1	0	113.9	S298 W299 W300	S298-K302 WeakPolarHBondContact O-CB 3.37Å; S298-K302 PolarHBondContact O-N 2.89Å; W299-K302 PolarHBondContact O-N 3.18Å; W300-K302 PolarHBondContact O-N 2.86Å
303	D	85.2	Confident	79.1	Confident	115 Å²	115	51.9 Å²	51.9	62%	0.615	28%	0.283	S	S	*	.	H	α-helix	trans	-95.8	-34.5	-179.2	-177	69.3	0	0	0	113.6	W299 W300 I301	W299-D303 WeakPolarHBondContact O-CB 3.29Å; W299-D303 PolarHBondContact O-N 2.98Å; W300-D303 PolarHBondContact O-N 3.03Å; I301-D303 VanDerWaalsContact C-N 3.32Å; I301-D303 PolarHBondContact O-N 2.9Å
304	K	80.3	Confident	79.1	Confident	120 Å²	120	57.5 Å²	57.5	52%	0.522	30%	0.303	S	S	.	.	H	α-helix	trans	-109	-25.5	-172.5	-58.8	-52.6	-173.9	-143.9	0	116	W300 P306	W300-K304 HydrophobicContact CD2-CB 4.24Å; W300-K304 HydrophobicContact CD2-CG 4.43Å; W300-K304 HydrophobicContact CE3-CB 4.31Å; W300-K304 HydrophobicContact CH2-CB 4.11Å; W300-K304 HydrophobicContact CZ2-CB 4.08Å; W300-K304 HydrophobicContact CZ2-CG 4.44Å; W300-K304 HydrophobicContact CZ3-CB 4.23Å; W300-K304 WeakPolarHBondContact O-CB 2.97Å; W300-K304 PolarHBondContact O-N 3.2Å; K304-P306 VanDerWaalsContact O-CD 3.27Å; K304-P306 WeakPolarHBondContact O-CD 3.39Å
305	A	69.8	Low	79.3	Confident	22 Å²	22	57.7 Å²	57.7	18%	0.182	30%	0.304	C	S	.	.	S	Bend	trans	-84	115.7	-178.5	0	0	0	0	0	110.7	I301	I301-A305 HydrophobicContact CG2-CB 4.15Å; I301-A305 VanDerWaalsContact O-CB 3.23Å; I301-A305 WeakPolarHBondContact O-CB 3.12Å; I301-A305 PolarHBondContact O-N 3.36Å
306	P	63.1	Low	79.5	Confident	66 Å²	66	62 Å²	62	43%	0.429	32%	0.324	S	S	.	.			trans	-63.8	152.4	176.5	24.3	-32.3	0	0	0	111.6	K304 N308 T309	K304-P306 VanDerWaalsContact O-CD 3.27Å; K304-P306 WeakPolarHBondContact O-CD 3.39Å; P306-N308 PolarHBondContact O-N 2.95Å; P306-T309 WeakPolarHBondContact CD-OG1 3.47Å; P306-T309 WeakPolarHBondContact CG-OG1 3.16Å; P306-T309 WeakPolarHBondContact O-CB 3.48Å; P306-T309 PolarHBondContact O-N 2.9Å; P306-T309 PolarHBondContact O-OG1 3.45Å
307	S	58.7	Low	79.6	Confident	140 Å²	140	63.9 Å²	63.9	98%	0.979	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-5.9	-171.9	54.1	0	0	0	0	115.7
308	N	58.4	Low	79.8	Confident	139 Å²	139	65.9 Å²	65.9	74%	0.743	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	1.4	173.1	64.7	-6.7	0	0	0	113.8	P306	P306-N308 PolarHBondContact O-N 2.95Å
309	T	56	Low	79.9	Confident	30 Å²	30	71.4 Å²	71.4	18%	0.184	39%	0.386	C	S	.	.			trans	-66.7	133.8	-178.9	-47.3	0	0	0	0	110.7	P306 C311	P306-T309 WeakPolarHBondContact CD-OG1 3.47Å; P306-T309 WeakPolarHBondContact CG-OG1 3.16Å; P306-T309 WeakPolarHBondContact O-CB 3.48Å; P306-T309 PolarHBondContact O-N 2.9Å; P306-T309 PolarHBondContact O-OG1 3.45Å; T309-C311 HydrophobicContact CG2-CB 3.84Å; T309-C311 PolarHBondContact O-N 3.21Å
310	A	53.1	Low	80.1	Confident	52 Å²	52	70.8 Å²	70.8	43%	0.43	40%	0.398	S	S	.	.			trans	-73	33	173.3	0	0	0	0	0	113.7	C312	A310-C312 PolarHBondContact O-N 3.14Å
311	C	60.3	Low	80.3	Confident	1 Å²	1	70 Å²	70	1%	0.007	40%	0.396	C	S	.	.			trans	-90.3	75.6	179.6	-166.4	0	0	0	0	110.6	I281 T309 A313 Y325	I281-C311 HydrophobicContact CG2-CB 4.33Å; I281-C311 VanDerWaalsContact O-CB 3.26Å; I281-C311 WeakPolarHBondContact O-CB 3.07Å; T309-C311 HydrophobicContact CG2-CB 3.84Å; T309-C311 PolarHBondContact O-N 3.21Å; C311-A313 VanDerWaalsContact C-N 3.29Å; C311-A313 PolarHBondContact O-N 3.45Å; C311-Y325 WeakPolarHBondContact O-CE2 3.25Å; C311-Y325 PolarHBondContact O-OH 3.33Å
312	C	72.4	Confident	80.6	Confident	63 Å²	63	75.7 Å²	75.7	43%	0.426	42%	0.42	S	S	.	.			trans	-89.4	49.6	178.3	-66.1	0	0	0	0	112.7	H284 A310	H284-C312 HydrophobicContact CB-CB 4.27Å; A310-C312 PolarHBondContact O-N 3.14Å
313	A	90.3	Very high	80.9	Confident	0 Å²	0	70 Å²	70	0%	0	41%	0.408	C	S	.	.			trans	-71.6	125.3	177.1	0	0	0	0	0	111.2	L283 C311 Y325 I326	L283-A313 HydrophobicContact CB-CB 3.86Å; C311-A313 VanDerWaalsContact C-N 3.29Å; C311-A313 PolarHBondContact O-N 3.45Å; A313-Y325 WeakPolarHBondContact O-CD2 3.5Å; A313-Y325 WeakPolarHBondContact O-CE2 3.39Å; A313-I326 HydrophobicContact CB-CD1 3.89Å; A313-I326 HydrophobicContact CB-CG1 4.34Å; A313-I326 PolarHBondContact O-N 3.18Å; A313-I326 VanDerWaalsContact O-N 3.13Å
314	R	93.8	Very high	81.3	Confident	144 Å²	144	69.7 Å²	69.7	54%	0.543	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-131.8	145.8	-176.6	-68.6	176.7	177.5	126.5	1.5	111.4	G323 R324	R314-G323 WeakPolarHBondContact CD-O 3.24Å; R314-R324 CarbonylContact C-O 3.1Å; R314-R324 WeakPolarHBondContact CA-O 3.19Å; R314-R324 WeakPolarHBondContact CB-O 3.5Å
315	C	96.2	Very high	81.8	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.034	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	137.3	177.5	-56.1	0	0	0	0	112	C290 L321 K322 G323 R324	C290-C315 HydrophobicContact CB-CB 3.84Å; C290-C315 WeakPolarHBondContact CB-SG 3.32Å; C290-C315 VanDerWaalsContact SG-CA 3.51Å; C290-C315 WeakPolarHBondContact SG-CB 3.49Å; C290-C315 CovalentContact SG-SG 2.03Å; C290-C315 PolarHBondContact SG-SG 3.38Å; C315-L321 HydrophobicContact CB-CB 4.29Å; C315-L321 WeakPolarHBondContact CB-O 3.23Å; C315-K322 WeakPolarHBondContact O-CA 3.42Å; C315-G323 PolarHBondContact O-N 2.85Å; C315-R324 PolarHBondContact N-O 2.72Å
316	H	97.3	Very high	82.9	Confident	90 Å²	90	65.8 Å²	65.8	42%	0.417	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-39.7	169.1	-165.8	98.3	0	0	0	111.8	P287 W288 K322	P287-H316 HydrophobicContact CB-CB 4.33Å; W288-H316 PolarHBondContact O-N 2.72Å; H316-K322 VanDerWaalsContact O-CD 3.31Å; H316-K322 WeakPolarHBondContact O-CD 3.3Å; H316-K322 WeakPolarHBondContact O-CG 3.19Å
317	T	95.8	Very high	84.2	Confident	52 Å²	52	63.2 Å²	63.2	32%	0.319	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	161.1	170.7	45.4	0	0	0	0	110.2	W288 N289 C290	W288-T317 PolarHBondContact O-N 2.78Å; N289-T317 WeakPolarHBondContact CA-OG1 3.33Å; N289-T317 WeakPolarHBondContact CB-OG1 3.48Å; N289-T317 WeakPolarHBondContact OD1-CB 3.45Å; N289-T317 PolarHBondContact OD1-OG1 3.17Å; C290-T317 PolarHBondContact N-O 2.89Å
318	P	96.2	Very high	85.6	Confident	42 Å²	42	62.7 Å²	62.7	27%	0.273	34%	0.343	S	S	.	.	S	Bend	cis	-66.3	164.9	-12.8	30.8	-37	0	0	0	112.1	C290 S320 L321 K322	C290-P318 WeakPolarHBondContact O-CD 3.25Å; P318-S320 PolarHBondContact O-N 3.01Å; P318-S320 VanDerWaalsContact O-N 3.11Å; P318-L321 HydrophobicContact CG-CB 4.36Å; P318-L321 HydrophobicContact CG-CD1 4.14Å; P318-L321 HydrophobicContact CG-CG 4.16Å; P318-L321 PolarHBondContact O-N 3.11Å; P318-K322 PolarHBondContact O-N 3.41Å; P318-K322 VanDerWaalsContact O-N 3.12Å
319	P	95.1	Very high	87.1	Confident	116 Å²	116	56.3 Å²	56.3	75%	0.753	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.1	-178.3	-27.9	36.2	0	0	0	114.8	L321 K322	P319-L321 VanDerWaalsContact C-N 3.31Å; P319-L321 PolarHBondContact O-N 3.32Å; P319-K322 PolarHBondContact O-N 3.06Å
320	S	94.9	Very high	88.7	Confident	95 Å²	95	57.5 Å²	57.5	66%	0.664	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-23.6	177.2	48.4	0	0	0	0	114.7	P318	P318-S320 PolarHBondContact O-N 3.01Å; P318-S320 VanDerWaalsContact O-N 3.11Å
321	L	94.8	Very high	90.4	Very high	11 Å²	11	59.2 Å²	59.2	6%	0.058	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-6	178	-59.5	179.6	0	0	0	112.6	C290 C315 P318 P319 G323 R324 L329 Y333 F334	C290-L321 HydrophobicContact CB-CD1 4.03Å; C315-L321 HydrophobicContact CB-CB 4.29Å; C315-L321 WeakPolarHBondContact CB-O 3.23Å; P318-L321 HydrophobicContact CG-CB 4.36Å; P318-L321 HydrophobicContact CG-CD1 4.14Å; P318-L321 HydrophobicContact CG-CG 4.16Å; P318-L321 PolarHBondContact O-N 3.11Å; P319-L321 VanDerWaalsContact C-N 3.31Å; P319-L321 PolarHBondContact O-N 3.32Å; L321-G323 PolarHBondContact O-N 2.96Å; L321-R324 VanDerWaalsContact O-CB 3.25Å; L321-R324 WeakPolarHBondContact O-CB 3.38Å; L321-R324 WeakPolarHBondContact O-CG 3.38Å; L321-R324 PolarHBondContact O-N 2.83Å; L321-L329 HydrophobicContact CD1-CD2 4.42Å; L321-Y333 HydrophobicContact CD2-CD1 4.05Å; L321-Y333 HydrophobicContact CD2-CG 4.39Å; L321-F334 HydrophobicContact CD1-CE1 3.57Å; L321-F334 HydrophobicContact CD1-CZ 3.6Å
322	K	95.5	Very high	91.7	Very high	124 Å²	124	66 Å²	66	54%	0.539	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	125.3	-175	-174.2	169.1	-170.4	161.6	0	112	C315 H316 P318 P319	C315-K322 WeakPolarHBondContact O-CA 3.42Å; H316-K322 VanDerWaalsContact O-CD 3.31Å; H316-K322 WeakPolarHBondContact O-CD 3.3Å; H316-K322 WeakPolarHBondContact O-CG 3.19Å; P318-K322 PolarHBondContact O-N 3.41Å; P318-K322 VanDerWaalsContact O-N 3.12Å; P319-K322 PolarHBondContact O-N 3.06Å
323	G	92.8	Very high	92.4	Very high	44 Å²	44	68.3 Å²	68.3	45%	0.454	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-14.9	-177.6	0	0	0	0	0	115.5	R314 C315 L321	R314-G323 WeakPolarHBondContact CD-O 3.24Å; C315-G323 PolarHBondContact O-N 2.85Å; L321-G323 PolarHBondContact O-N 2.96Å
324	R	92.6	Very high	92.5	Very high	107 Å²	107	70 Å²	70	40%	0.404	36%	0.36	S	S	.	.			trans	-64.3	150.3	173.4	-68.6	-177	175.4	-88	-1.4	111.4	R314 C315 L321	R314-R324 CarbonylContact C-O 3.1Å; R314-R324 WeakPolarHBondContact CA-O 3.19Å; R314-R324 WeakPolarHBondContact CB-O 3.5Å; C315-R324 PolarHBondContact N-O 2.72Å; L321-R324 VanDerWaalsContact O-CB 3.25Å; L321-R324 WeakPolarHBondContact O-CB 3.38Å; L321-R324 WeakPolarHBondContact O-CG 3.38Å; L321-R324 PolarHBondContact O-N 2.83Å
325	Y	91.9	Very high	92.4	Very high	60 Å²	60	69 Å²	69	24%	0.235	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-75	141	175	-174.7	-125	0	0	0	111	I301 C311 A313 E328	I301-Y325 HydrophobicContact CG2-CE1 4.29Å; I301-Y325 WeakPolarHBondContact CG2-OH 3.39Å; C311-Y325 WeakPolarHBondContact O-CE2 3.25Å; C311-Y325 PolarHBondContact O-OH 3.33Å; A313-Y325 WeakPolarHBondContact O-CD2 3.5Å; A313-Y325 WeakPolarHBondContact O-CE2 3.39Å; Y325-E328 WeakPolarHBondContact CB-OE1 3.43Å; Y325-E328 HydrophobicContact CD1-CG 4.11Å; Y325-E328 PolarHBondContact O-N 3Å
326	I	92.7	Very high	92.2	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-69.1	-40.3	-176.2	-66.4	-178.2	0	0	0	111.8	W288 I294 L297 S298 I301 A313 E328 L329	W288-I326 HydrophobicContact CB-CD1 3.84Å; W288-I326 HydrophobicContact CD2-CD1 4.09Å; W288-I326 HydrophobicContact CG-CD1 3.57Å; I294-I326 HydrophobicContact CD1-CD1 4.37Å; I294-I326 HydrophobicContact CG1-CD1 4.22Å; I294-I326 HydrophobicContact CG1-CG2 3.92Å; L297-I326 HydrophobicContact CD2-CG2 4.46Å; L297-I326 HydrophobicContact CG-CG2 4.44Å; S298-I326 WeakPolarHBondContact CB-O 3.42Å; S298-I326 PolarHBondContact OG-O 3.35Å; I301-I326 HydrophobicContact CD1-CB 4.46Å; I301-I326 HydrophobicContact CD1-CG2 4.19Å; A313-I326 HydrophobicContact CB-CD1 3.89Å; A313-I326 HydrophobicContact CB-CG1 4.34Å; A313-I326 PolarHBondContact O-N 3.18Å; A313-I326 VanDerWaalsContact O-N 3.13Å; I326-E328 PolarHBondContact O-N 2.93Å; I326-E328 VanDerWaalsContact O-N 3.15Å; I326-L329 HydrophobicContact CG2-CD1 4.44Å; I326-L329 WeakPolarHBondContact O-CB 3.31Å; I326-L329 WeakPolarHBondContact O-CG 3.27Å; I326-L329 PolarHBondContact O-N 3.12Å; I326-L329 VanDerWaalsContact O-N 3.09Å
327	G	88.9	Confident	91.9	Very high	12 Å²	12	74 Å²	74	12%	0.124	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-71	-3	179.4	0	0	0	0	0	115.5
328	E	88.5	Confident	91.7	Very high	130 Å²	130	74 Å²	74	61%	0.607	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-92.3	-8.8	171.3	-79.1	161.4	-147.4	0	0	112.7	Y325 I326	Y325-E328 WeakPolarHBondContact CB-OE1 3.43Å; Y325-E328 HydrophobicContact CD1-CG 4.11Å; Y325-E328 PolarHBondContact O-N 3Å; I326-E328 PolarHBondContact O-N 2.93Å; I326-E328 VanDerWaalsContact O-N 3.15Å
329	L	90.8	Very high	91.6	Very high	4 Å²	4	72.2 Å²	72.2	2%	0.021	38%	0.382	C	S	.	.			trans	-78.9	126.1	-175.1	-60.3	174.1	0	0	0	111.5	C290 I294 S298 L321 I326 F334	C290-L329 HydrophobicContact CB-CD1 3.94Å; I294-L329 HydrophobicContact CG2-CD1 3.68Å; S298-L329 WeakPolarHBondContact CB-O 3.37Å; S298-L329 PolarHBondContact OG-O 3.33Å; L321-L329 HydrophobicContact CD1-CD2 4.42Å; I326-L329 HydrophobicContact CG2-CD1 4.44Å; I326-L329 WeakPolarHBondContact O-CB 3.31Å; I326-L329 WeakPolarHBondContact O-CG 3.27Å; I326-L329 PolarHBondContact O-N 3.12Å; I326-L329 VanDerWaalsContact O-N 3.09Å; L329-F334 HydrophobicContact CB-CE2 4.4Å; L329-F334 HydrophobicContact CD1-CZ 4.45Å
330	D	88.1	Confident	91.5	Very high	55 Å²	55	70.9 Å²	70.9	29%	0.294	37%	0.372	S	S	.	.			trans	-110.8	179.6	171.1	70.7	16.1	0	0	0	111.9	N332 Y333 F334	D330-N332 VanDerWaalsContact CG-ND2 3.26Å; D330-N332 PolarHBondContact O-N 2.83Å; D330-N332 WeakPolarHBondContact OD1-CA 3.4Å; D330-N332 VanDerWaalsContact OD1-CB 3.25Å; D330-N332 WeakPolarHBondContact OD1-CB 3.34Å; D330-N332 PolarHBondContact OD1-N 2.86Å; D330-N332 PolarHBondContact OD1-ND2 2.76Å; D330-N332 PolarHBondContact OD2-ND2 2.93Å; D330-Y333 VanDerWaalsContact OD1-CD2 3.24Å; D330-Y333 WeakPolarHBondContact OD1-CD2 3.31Å; D330-Y333 PolarHBondContact OD1-N 3.21Å; D330-F334 VanDerWaalsContact O-CD2 3.32Å; D330-F334 WeakPolarHBondContact O-CD2 3.22Å; D330-F334 WeakPolarHBondContact O-CE2 3.27Å
331	L	88.8	Confident	91.5	Very high	89 Å²	89	67.6 Å²	67.6	47%	0.466	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-68.6	-21.4	178.1	-171.2	64.5	0	0	0	112.8	L295 Y333 F334 C336	L295-L331 HydrophobicContact CD1-CD1 3.7Å; L331-Y333 PolarHBondContact O-N 3.13Å; L331-F334 PolarHBondContact O-N 3.29Å; L331-C336 HydrophobicContact CD1-CB 4.26Å
332	N	88.3	Confident	91.5	Very high	143 Å²	143	71.6 Å²	71.6	77%	0.765	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-69	-19.6	-175	-56	-58.6	0	0	0	112.7	D330 F334	D330-N332 VanDerWaalsContact CG-ND2 3.26Å; D330-N332 PolarHBondContact O-N 2.83Å; D330-N332 WeakPolarHBondContact OD1-CA 3.4Å; D330-N332 VanDerWaalsContact OD1-CB 3.25Å; D330-N332 WeakPolarHBondContact OD1-CB 3.34Å; D330-N332 PolarHBondContact OD1-N 2.86Å; D330-N332 PolarHBondContact OD1-ND2 2.76Å; D330-N332 PolarHBondContact OD2-ND2 2.93Å; N332-F334 VanDerWaalsContact C-N 3.29Å
333	Y	87.5	Confident	91.5	Very high	111 Å²	111	68.7 Å²	68.7	44%	0.435	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-77.9	-6	172.7	-67.8	-70.7	0	0	0	114.3	L321 D330 L331	L321-Y333 HydrophobicContact CD2-CD1 4.05Å; L321-Y333 HydrophobicContact CD2-CG 4.39Å; D330-Y333 VanDerWaalsContact OD1-CD2 3.24Å; D330-Y333 WeakPolarHBondContact OD1-CD2 3.31Å; D330-Y333 PolarHBondContact OD1-N 3.21Å; L331-Y333 PolarHBondContact O-N 3.13Å
334	F	91.8	Very high	91.6	Very high	35 Å²	35	70.2 Å²	70.2	15%	0.154	36%	0.361	C	S	.	.			trans	-141.6	154	-168.8	-50.1	-76.3	0	0	0	114	C290 L295 L321 L329 D330 L331 N332 C336	C290-F334 WeakPolarHBondContact O-CE1 3.23Å; L295-F334 HydrophobicContact CD1-CD2 4.14Å; L295-F334 HydrophobicContact CD2-CD2 3.84Å; L295-F334 HydrophobicContact CD2-CE2 3.82Å; L295-F334 HydrophobicContact CG-CD2 4.16Å; L295-F334 HydrophobicContact CG-CE2 4.31Å; L321-F334 HydrophobicContact CD1-CE1 3.57Å; L321-F334 HydrophobicContact CD1-CZ 3.6Å; L329-F334 HydrophobicContact CB-CE2 4.4Å; L329-F334 HydrophobicContact CD1-CZ 4.45Å; D330-F334 VanDerWaalsContact O-CD2 3.32Å; D330-F334 WeakPolarHBondContact O-CD2 3.22Å; D330-F334 WeakPolarHBondContact O-CE2 3.27Å; L331-F334 PolarHBondContact O-N 3.29Å; N332-F334 VanDerWaalsContact C-N 3.29Å; F334-C336 WeakPolarHBondContact CB-SG 3.47Å
335	T	91.4	Very high	91.9	Very high	123 Å²	123	65.8 Å²	65.8	76%	0.755	35%	0.347	S	S	*	.			trans	-112.7	92.7	170.8	41.1	0	0	0	0	109.6
336	C	91.9	Very high	92.1	Very high	22 Å²	22	66.4 Å²	66.4	15%	0.149	36%	0.364	C	S	.	.			trans	-110.3	152.2	-170	-52.3	0	0	0	0	112.5	C292 L331 F334 V417	C292-C336 VanDerWaalsContact CA-SG 3.59Å; C292-C336 HydrophobicContact CB-CB 3.78Å; C292-C336 WeakPolarHBondContact CB-SG 3.27Å; C292-C336 WeakPolarHBondContact SG-CA 3.21Å; C292-C336 WeakPolarHBondContact SG-CB 3.25Å; C292-C336 CovalentContact SG-SG 2.03Å; C292-C336 PolarHBondContact SG-SG 3.31Å; L331-C336 HydrophobicContact CD1-CB 4.26Å; F334-C336 WeakPolarHBondContact CB-SG 3.47Å; C336-V417 HydrophobicContact CB-CG2 3.4Å; C336-V417 VanDerWaalsContact CB-CG2 3.4Å
337	Y	91.2	Very high	92.3	Very high	180 Å²	180	71.7 Å²	71.7	71%	0.706	39%	0.392	S	S	*	.			trans	-132.6	162.9	-176.7	-57.2	-83.2	0	0	0	111.3	N415	Y337-N415 PolarHBondContact O-ND2 3.13Å
338	A	91.3	Very high	92.6	Very high	50 Å²	50	73.8 Å²	73.8	41%	0.413	40%	0.401	S	S	.	.			trans	-58	154.1	170.8	0	0	0	0	0	111.8
339	P	94.1	Very high	92.9	Very high	5 Å²	5	73.7 Å²	73.7	3%	0.032	40%	0.404	C	S	.	.			trans	-71.1	145.3	-174.7	29.1	-33.2	0	0	0	111.5	T367 V413 N415 G418 T420	P339-T367 HydrophobicContact CB-CG2 3.83Å; P339-V413 HydrophobicContact CB-CG1 3.86Å; P339-V413 HydrophobicContact CG-CB 4.46Å; P339-V413 HydrophobicContact CG-CG1 4.13Å; P339-V413 WeakPolarHBondContact CG-O 3.5Å; P339-N415 HydrophobicContact CB-CB 4.34Å; P339-N415 HydrophobicContact CG-CB 4.5Å; P339-G418 WeakPolarHBondContact CD-O 3.19Å; P339-T420 VanDerWaalsContact O-CB 3.22Å; P339-T420 WeakPolarHBondContact O-CB 3.31Å; P339-T420 PolarHBondContact O-OG1 3.28Å
340	V	94.1	Very high	93.1	Very high	88 Å²	88	74.1 Å²	74.1	53%	0.533	41%	0.407	S	S	.	.			trans	-105.4	130.8	179.6	-179.8	0	0	0	0	109.5	A362 S363	V340-A362 CarbonylContact O-C 3.6Å; V340-A362 WeakPolarHBondContact O-CA 3.37Å; V340-S363 PolarHBondContact O-N 3.23Å
341	I	95	Very high	93.4	Very high	26 Å²	26	73.8 Å²	73.8	13%	0.133	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.5	171.1	-54.8	177.7	0	0	0	107.2	P344 V413 T420 A422	I341-P344 HydrophobicContact CG2-CB 3.97Å; I341-V413 HydrophobicContact CD1-CG2 3.95Å; I341-V413 HydrophobicContact CG1-CB 4.36Å; I341-V413 HydrophobicContact CG1-CG2 3.84Å; I341-T420 HydrophobicContact CD1-CG2 4.04Å; I341-T420 HydrophobicContact CG1-CG2 4.12Å; I341-A422 HydrophobicContact CD1-CB 3.72Å
342	V	94.9	Very high	93.6	Very high	95 Å²	95	72.8 Å²	72.8	58%	0.576	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	-46.2	-173.5	179.7	0	0	0	0	111.3	P344 R361	V342-P344 WeakPolarHBondContact O-CD 3.44Å; V342-R361 PolarHBondContact N-O 3.3Å
343	E	94.9	Very high	93.7	Very high	63 Å²	63	67.7 Å²	67.7	29%	0.294	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	95	166.8	-61	-179.8	-121.4	0	0	107.2	K359 C360 R361	E343-K359 WeakPolarHBondContact OE2-CD 3.28Å; E343-K359 WeakPolarHBondContact OE2-CE 3.29Å; E343-K359 IonicContact OE2-NZ 3.35Å; E343-K359 PolarHBondContact OE2-NZ 3.44Å; E343-C360 WeakPolarHBondContact O-CA 3.49Å; E343-R361 HydrophobicContact CB-CB 4.07Å; E343-R361 HydrophobicContact CB-CG 4.49Å; E343-R361 HydrophobicContact CG-CB 4.48Å; E343-R361 PolarHBondContact N-O 3.36Å; E343-R361 PolarHBondContact O-N 2.79Å; E343-R361 WeakPolarHBondContact OE1-CD 3.44Å; E343-R361 IonicContact OE1-CZ 3.42Å; E343-R361 IonicContact OE1-NE 2.69Å; E343-R361 IonicContact OE1-NH1 2.71Å; E343-R361 PolarHBondContact OE1-NH1 2.92Å
344	P	95.8	Very high	93.9	Very high	76 Å²	76	67.9 Å²	67.9	49%	0.494	39%	0.387	S	S	.	.			trans	-73.2	159.4	172.9	31.6	-34.9	0	0	0	111.1	I341 V342 K359 A422	I341-P344 HydrophobicContact CG2-CB 3.97Å; V342-P344 WeakPolarHBondContact O-CD 3.44Å; P344-K359 CarbonylContact C-O 3.54Å; P344-A422 HydrophobicContact CB-CB 4.12Å
345	P	97.1	Very high	94	Very high	15 Å²	15	69.5 Å²	69.5	10%	0.097	41%	0.407	C	S	.	.			trans	-68.7	150.9	174.5	29.1	-34.6	0	0	0	111.3	M358 K359 W371 A422 A424	P345-M358 HydrophobicContact CB-CE 4.45Å; P345-K359 WeakPolarHBondContact CA-O 3.41Å; P345-K359 VanDerWaalsContact CB-O 3.27Å; P345-K359 WeakPolarHBondContact CB-O 3.45Å; P345-K359 WeakPolarHBondContact CD-O 3.1Å; P345-W371 HydrophobicContact CB-CH2 3.9Å; P345-W371 HydrophobicContact CG-CH2 4.03Å; P345-A422 HydrophobicContact CG-CB 4.35Å; P345-A424 HydrophobicContact CB-CB 3.81Å; P345-A424 HydrophobicContact CG-CB 4.12Å
346	A	96.8	Very high	94.2	Very high	73 Å²	73	64 Å²	64	60%	0.603	37%	0.374	S	S	*	.			trans	-118.9	156.1	173.2	0	0	0	0	0	109.8
347	D	97.1	Very high	94.4	Very high	110 Å²	110	68.3 Å²	68.3	59%	0.588	39%	0.392	S	S	*	.			trans	-62.4	137.9	177	-58.8	-65.4	0	0	0	111.1	T425	D347-T425 WeakPolarHBondContact CA-O 3.3Å; D347-T425 WeakPolarHBondContact OD1-CB 3.22Å; D347-T425 PolarHBondContact OD1-N 3.33Å; D347-T425 PolarHBondContact OD1-OG1 2.81Å
348	L	95.4	Very high	94.6	Very high	57 Å²	57	59.9 Å²	59.9	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.5	-170	-166.6	72	0	0	0	111.8	V350 A356 T425 L426 N427	L348-V350 HydrophobicContact CD2-CG2 3.6Å; L348-V350 HydrophobicContact CG-CG2 3.61Å; L348-A356 HydrophobicContact CD2-CB 3.91Å; L348-T425 PolarHBondContact N-O 2.87Å; L348-L426 HydrophobicContact CB-CD1 4.21Å; L348-L426 HydrophobicContact CD2-CD1 4.17Å; L348-L426 HydrophobicContact CG-CD1 4.48Å; L348-N427 PolarHBondContact O-N 2.83Å
349	N	95.1	Very high	94.8	Very high	127 Å²	127	61.9 Å²	61.9	68%	0.679	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.8	172	-64.4	-48.3	0	0	0	109.4	N427	N349-N427 WeakPolarHBondContact CA-O 3.44Å; N349-N427 WeakPolarHBondContact OD1-CB 3.37Å; N349-N427 PolarHBondContact OD1-ND2 3.36Å
350	V	94.5	Very high	94.9	Very high	14 Å²	14	61.7 Å²	61.7	9%	0.085	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.9	-174.6	-169.5	0	0	0	0	110.1	L348 M354 A356 V401 L426 N427 V428 T429	L348-V350 HydrophobicContact CD2-CG2 3.6Å; L348-V350 HydrophobicContact CG-CG2 3.61Å; V350-M354 HydrophobicContact CG1-CB 3.84Å; V350-A356 HydrophobicContact CG1-CB 4.46Å; V350-A356 HydrophobicContact CG2-CB 4.05Å; V350-V401 HydrophobicContact CG1-CG2 4.41Å; V350-L426 HydrophobicContact CG2-CD1 3.86Å; V350-N427 PolarHBondContact N-O 2.78Å; V350-V428 CarbonylContact O-C 3.59Å; V350-V428 VanDerWaalsContact O-CA 3.26Å; V350-V428 WeakPolarHBondContact O-CA 3.47Å; V350-T429 PolarHBondContact O-N 3.43Å; V350-T429 PolarHBondContact O-OG1 2.85Å
351	T	93.9	Very high	94.9	Very high	47 Å²	47	62 Å²	62	29%	0.288	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	143.2	171.1	55.1	0	0	0	0	111.3	G353 M354 T429	T351-G353 PolarHBondContact O-N 2.81Å; T351-M354 PolarHBondContact O-N 2.86Å; T351-M354 VanDerWaalsContact OG1-CE 3.25Å; T351-M354 WeakPolarHBondContact OG1-CE 3.48Å; T351-M354 WeakPolarHBondContact OG1-CG 3.35Å; T351-M354 PolarHBondContact OG1-SD 3.15Å; T351-T429 CarbonylContact C-O 3.59Å; T351-T429 WeakPolarHBondContact CA-O 3.08Å; T351-T429 WeakPolarHBondContact CG2-OG1 3.29Å
352	E	93.7	Very high	94.7	Very high	69 Å²	69	61.6 Å²	61.6	32%	0.322	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	136.1	178.9	178	160.6	-112.9	0	0	112.6	T402 V403 V428 T429	E352-T402 VanDerWaalsContact OE1-CA 3.26Å; E352-T402 WeakPolarHBondContact OE1-CA 3.11Å; E352-V403 HydrophobicContact CB-CG2 4.36Å; E352-V403 PolarHBondContact OE1-N 3.4Å; E352-V428 HydrophobicContact CB-CG1 4.25Å; E352-T429 PolarHBondContact N-O 2.83Å
353	G	90.5	Very high	94.4	Very high	36 Å²	36	60.7 Å²	60.7	37%	0.371	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-13.6	179.4	0	0	0	0	0	115.8	T351 V401	T351-G353 PolarHBondContact O-N 2.81Å; G353-V401 PolarHBondContact N-O 3.4Å
354	M	92.3	Very high	93.9	Very high	114 Å²	114	59.5 Å²	59.5	56%	0.562	34%	0.344	S	S	*	.	S	Bend	trans	-74	165.3	169.3	-67.8	-169.8	178.2	0	0	112	V350 T351 V401	V350-M354 HydrophobicContact CG1-CB 3.84Å; T351-M354 PolarHBondContact O-N 2.86Å; T351-M354 VanDerWaalsContact OG1-CE 3.25Å; T351-M354 WeakPolarHBondContact OG1-CE 3.48Å; T351-M354 WeakPolarHBondContact OG1-CG 3.35Å; T351-M354 PolarHBondContact OG1-SD 3.15Å; M354-V401 WeakPolarHBondContact O-CG2 3.35Å; M354-V401 PolarHBondContact O-N 3.26Å
355	A	94.1	Very high	93.4	Very high	69 Å²	69	60 Å²	60	57%	0.57	35%	0.35	S	S	*	.			trans	-85.7	155.6	166.3	0	0	0	0	0	110.7	F398	A355-F398 WeakPolarHBondContact CA-O 3.39Å; A355-F398 WeakPolarHBondContact CB-O 3.27Å
356	A	94.6	Very high	92.9	Very high	8 Å²	8	60.6 Å²	60.6	7%	0.066	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150.5	179.2	0	0	0	0	0	112.2	L348 V350 F398 V401	L348-A356 HydrophobicContact CD2-CB 3.91Å; V350-A356 HydrophobicContact CG1-CB 4.46Å; V350-A356 HydrophobicContact CG2-CB 4.05Å; A356-F398 HydrophobicContact CB-CB 4.25Å; A356-F398 HydrophobicContact CB-CD2 4.29Å; A356-F398 PolarHBondContact N-O 2.79Å; A356-F398 VanDerWaalsContact N-O 3.07Å; A356-F398 PolarHBondContact O-N 2.82Å; A356-V401 HydrophobicContact CB-CG2 3.57Å
357	E	95.6	Very high	92.7	Very high	113 Å²	113	57.1 Å²	57.1	53%	0.528	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	121.8	177.9	-66.6	-172.8	163.9	0	0	110.6	T395 L396	E357-T395 HydrophobicContact CB-CG2 4.01Å; E357-T395 HydrophobicContact CG-CG2 4.49Å; E357-L396 CarbonylContact C-O 3.55Å; E357-L396 WeakPolarHBondContact CA-O 3.28Å
358	M	96.1	Very high	92.4	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	104.1	170.6	-59.9	-177.1	73	0	0	108.8	P345 W371 T395 L396 F398 Y409 A424 L426	P345-M358 HydrophobicContact CB-CE 4.45Å; M358-W371 HydrophobicContact CB-CH2 3.75Å; M358-W371 HydrophobicContact CB-CZ2 4.25Å; M358-W371 HydrophobicContact CB-CZ3 4.45Å; M358-W371 HydrophobicContact CE-CZ3 4.39Å; M358-W371 VanDerWaalsContact O-CZ2 3.28Å; M358-W371 WeakPolarHBondContact O-CZ2 3.21Å; M358-T395 WeakPolarHBondContact O-CA 3.37Å; M358-L396 HydrophobicContact CB-CB 4.32Å; M358-L396 PolarHBondContact N-O 2.9Å; M358-L396 PolarHBondContact O-N 2.78Å; M358-F398 HydrophobicContact CG-CE2 4.32Å; M358-F398 HydrophobicContact SD-CE2 4.24Å; M358-Y409 HydrophobicContact CE-CG 4.48Å; M358-Y409 HydrophobicContact SD-CD2 4.06Å; M358-Y409 HydrophobicContact SD-CG 4.04Å; M358-A424 HydrophobicContact CE-CB 3.79Å; M358-L426 HydrophobicContact SD-CB 4.17Å
359	K	96.2	Very high	92.4	Very high	93 Å²	93	50.2 Å²	50.2	40%	0.404	29%	0.288	S	S	.	.			trans	-65.6	139.5	-178.2	-69.6	-179.5	162.7	-164.2	0	112	E343 P344 P345 T395	E343-K359 WeakPolarHBondContact OE2-CD 3.28Å; E343-K359 WeakPolarHBondContact OE2-CE 3.29Å; E343-K359 IonicContact OE2-NZ 3.35Å; E343-K359 PolarHBondContact OE2-NZ 3.44Å; P344-K359 CarbonylContact C-O 3.54Å; P345-K359 WeakPolarHBondContact CA-O 3.41Å; P345-K359 VanDerWaalsContact CB-O 3.27Å; P345-K359 WeakPolarHBondContact CB-O 3.45Å; P345-K359 WeakPolarHBondContact CD-O 3.1Å; K359-T395 HydrophobicContact CG-CG2 4.48Å
360	C	95.6	Very high	92.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.263	C	S	.	.			trans	-150.3	91	163.5	-175.2	0	0	0	0	109.8	E343 W371 G394 C411	E343-C360 WeakPolarHBondContact O-CA 3.49Å; C360-W371 HydrophobicContact CB-CH2 4.28Å; C360-W371 HydrophobicContact CB-CZ2 3.47Å; C360-W371 VanDerWaalsContact CB-CZ2 3.47Å; C360-G394 CarbonylContact O-C 3.6Å; C360-G394 WeakPolarHBondContact O-CA 3.35Å; C360-C411 HydrophobicContact CB-CB 3.64Å; C360-C411 WeakPolarHBondContact CB-SG 3.04Å; C360-C411 WeakPolarHBondContact SG-CB 3.06Å; C360-C411 CovalentContact SG-SG 2.02Å; C360-C411 PolarHBondContact SG-SG 2.89Å
361	R	93.7	Very high	92.4	Very high	96 Å²	96	44.6 Å²	44.6	36%	0.362	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	119.3	-177.7	-70.9	171.7	165.1	-167.2	-6.8	111.1	V342 E343 D393	V342-R361 PolarHBondContact N-O 3.3Å; E343-R361 HydrophobicContact CB-CB 4.07Å; E343-R361 HydrophobicContact CB-CG 4.49Å; E343-R361 HydrophobicContact CG-CB 4.48Å; E343-R361 PolarHBondContact N-O 3.36Å; E343-R361 PolarHBondContact O-N 2.79Å; E343-R361 WeakPolarHBondContact OE1-CD 3.44Å; E343-R361 IonicContact OE1-CZ 3.42Å; E343-R361 IonicContact OE1-NE 2.69Å; E343-R361 IonicContact OE1-NH1 2.71Å; E343-R361 PolarHBondContact OE1-NH1 2.92Å; R361-D393 HydrophobicContact CG-CB 4.37Å; R361-D393 IonicContact CZ-OD2 3.9Å; R361-D393 IonicContact NE-OD2 3.16Å; R361-D393 PolarHBondContact NE-OD2 3.33Å; R361-D393 IonicContact NH2-OD2 2.72Å; R361-D393 PolarHBondContact NH2-OD2 3.26Å
362	A	91.4	Very high	92.5	Very high	17 Å²	17	44.7 Å²	44.7	14%	0.14	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	158.9	173.3	0	0	0	0	0	112.1	V340 T364 T367 V413	V340-A362 CarbonylContact O-C 3.6Å; V340-A362 WeakPolarHBondContact O-CA 3.37Å; A362-T364 PolarHBondContact O-N 3.24Å; A362-T367 HydrophobicContact CB-CG2 4.21Å; A362-T367 WeakPolarHBondContact CB-OG1 3.13Å; A362-V413 HydrophobicContact CB-CG1 3.66Å
363	S	87.1	Confident	92.5	Very high	75 Å²	75	41.9 Å²	41.9	52%	0.524	25%	0.245	S	C	.	.	S	Bend	trans	-64.3	-20.3	178	58.2	0	0	0	0	115	V340	V340-S363 PolarHBondContact O-N 3.23Å
364	T	85.3	Confident	92.6	Very high	38 Å²	38	42.8 Å²	42.8	23%	0.233	24%	0.244	C	C	.	.	S	Bend	trans	-137.6	138	170.9	176.2	0	0	0	0	110.3	R246 A362 L366 T367	R246-T364 PolarHBondContact NH2-O 2.86Å; A362-T364 PolarHBondContact O-N 3.24Å; T364-L366 PolarHBondContact O-N 2.92Å; T364-L366 PolarHBondContact OG1-N 3.48Å; T364-T367 HydrophobicContact CG2-CG2 3.72Å; T364-T367 PolarHBondContact O-N 3.16Å; T364-T367 PolarHBondContact O-OG1 3.46Å
365	S	84.5	Confident	92.5	Very high	88 Å²	88	44.3 Å²	44.3	62%	0.615	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.8	177.1	51.4	0	0	0	0	113.6	R246	R246-S365 PolarHBondContact NE-O 3.37Å; R246-S365 VanDerWaalsContact NE-O 3.07Å; R246-S365 PolarHBondContact NH2-O 3.26Å
366	L	87.4	Confident	92.3	Very high	26 Å²	26	43.5 Å²	43.5	14%	0.136	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-16.2	179.1	-62.2	166	0	0	0	113.4	L267 P269 H270 D293 T364	L267-L366 HydrophobicContact CB-CD1 3.56Å; L267-L366 HydrophobicContact CB-CD2 3.97Å; L267-L366 HydrophobicContact CB-CG 4.44Å; L267-L366 HydrophobicContact CD1-CD1 3.31Å; L267-L366 HydrophobicContact CG-CD1 3.93Å; P269-L366 WeakPolarHBondContact CA-O 3.3Å; H270-L366 WeakPolarHBondContact CB-O 3.07Å; H270-L366 PolarHBondContact N-O 2.87Å; D293-L366 HydrophobicContact CB-CD1 4.12Å; T364-L366 PolarHBondContact O-N 2.92Å; T364-L366 PolarHBondContact OG1-N 3.48Å
367	T	91.8	Very high	92.2	Very high	1 Å²	1	45 Å²	45	1%	0.006	26%	0.263	C	S	.	.	S	Bend	trans	-58.3	142.7	169.5	49.3	0	0	0	0	110.8	R246 P339 A362 T364 V413 S414 N415	R246-T367 PolarHBondContact NE-O 3.15Å; R246-T367 PolarHBondContact NH2-O 2.97Å; R246-T367 VanDerWaalsContact NH2-O 3.13Å; R246-T367 PolarHBondContact NH2-OG1 3.34Å; P339-T367 HydrophobicContact CB-CG2 3.83Å; A362-T367 HydrophobicContact CB-CG2 4.21Å; A362-T367 WeakPolarHBondContact CB-OG1 3.13Å; T364-T367 HydrophobicContact CG2-CG2 3.72Å; T364-T367 PolarHBondContact O-N 3.16Å; T364-T367 PolarHBondContact O-OG1 3.46Å; T367-V413 HydrophobicContact CG2-CG1 3.84Å; T367-S414 WeakPolarHBondContact CA-O 3.46Å; T367-S414 WeakPolarHBondContact CB-O 3.28Å; T367-N415 HydrophobicContact CG2-CB 4.24Å
368	S	92.1	Very high	92	Very high	19 Å²	19	43.8 Å²	43.8	13%	0.133	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	132.8	164.7	28.8	0	0	0	0	109	H270 V413 S414	H270-S368 PolarHBondContact ND1-OG 3.17Å; H270-S368 VanDerWaalsContact ND1-OG 3.08Å; S368-V413 WeakPolarHBondContact O-CA 3.34Å; S368-S414 PolarHBondContact N-O 3Å; S368-S414 VanDerWaalsContact N-O 3.09Å; S368-S414 PolarHBondContact O-N 2.98Å; S368-S414 PolarHBondContact OG-O 2.82Å; S368-S414 PolarHBondContact OG-OG 3.46Å
369	V	94.5	Very high	91.8	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.018	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.9	176.9	178.7	0	0	0	0	108.3	R246 V413	R246-V369 VanDerWaalsContact CZ-CG2 3.48Å; R246-V369 VanDerWaalsContact NH2-CG2 3.26Å; V369-V413 HydrophobicContact CG2-CG1 4.29Å; V369-V413 HydrophobicContact CG2-CG2 4.15Å
370	S	94.4	Very high	91.6	Very high	22 Å²	22	41.1 Å²	41.1	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	149.8	178.9	62.1	0	0	0	0	110.4	M379 M412	S370-M379 CarbonylContact C-O 3.55Å; S370-M379 VanDerWaalsContact CA-O 3.3Å; S370-M379 WeakPolarHBondContact CA-O 3.06Å; S370-M412 PolarHBondContact N-O 3.44Å; S370-M412 PolarHBondContact O-N 3.37Å; S370-M412 PolarHBondContact OG-O 2.94Å
371	W	95.9	Very high	91.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.1	-178.9	-82.4	92.3	0	0	0	110.5	P345 M358 C360 V378 M379 V390 G394 L396 C411	P345-W371 HydrophobicContact CB-CH2 3.9Å; P345-W371 HydrophobicContact CG-CH2 4.03Å; M358-W371 HydrophobicContact CB-CH2 3.75Å; M358-W371 HydrophobicContact CB-CZ2 4.25Å; M358-W371 HydrophobicContact CB-CZ3 4.45Å; M358-W371 HydrophobicContact CE-CZ3 4.39Å; M358-W371 VanDerWaalsContact O-CZ2 3.28Å; M358-W371 WeakPolarHBondContact O-CZ2 3.21Å; C360-W371 HydrophobicContact CB-CH2 4.28Å; C360-W371 HydrophobicContact CB-CZ2 3.47Å; C360-W371 VanDerWaalsContact CB-CZ2 3.47Å; W371-V378 CarbonylContact O-C 3.39Å; W371-V378 WeakPolarHBondContact O-CA 3.44Å; W371-M379 HydrophobicContact CB-CB 4.38Å; W371-M379 PolarHBondContact N-O 3.37Å; W371-M379 PolarHBondContact O-N 2.73Å; W371-V390 HydrophobicContact CB-CG2 4.47Å; W371-V390 HydrophobicContact CG-CG2 4.41Å; W371-G394 PolarHBondContact NE1-O 3.24Å; W371-L396 HydrophobicContact CB-CD1 4.28Å; W371-L396 HydrophobicContact CD2-CB 3.91Å; W371-L396 HydrophobicContact CD2-CD2 4.02Å; W371-L396 HydrophobicContact CD2-CG 4.41Å; W371-L396 HydrophobicContact CE3-CB 4.48Å; W371-L396 HydrophobicContact CE3-CD2 4Å; W371-L396 HydrophobicContact CG-CB 4.19Å; W371-L396 HydrophobicContact CG-CD1 4.14Å; W371-L396 HydrophobicContact CG-CD2 4.28Å; W371-L396 HydrophobicContact CG-CG 4.46Å; W371-L396 HydrophobicContact CH2-CB 4.41Å; W371-L396 HydrophobicContact CZ2-CB 3.86Å; W371-L396 HydrophobicContact CZ3-CD2 4.46Å; W371-C411 HydrophobicContact CD2-CB 4.04Å; W371-C411 HydrophobicContact CE3-CB 4.05Å; W371-C411 HydrophobicContact CH2-CB 3.9Å; W371-C411 HydrophobicContact CZ2-CB 3.84Å; W371-C411 HydrophobicContact CZ3-CB 3.98Å
372	I	95.8	Very high	90.8	Very high	50 Å²	50	38.4 Å²	38.4	26%	0.256	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	116.3	173	-52.3	174.4	0	0	0	107.3	V378 Y409 T410 M412	I372-V378 HydrophobicContact CG1-CG2 4.47Å; I372-Y409 WeakPolarHBondContact O-CA 3.36Å; I372-T410 PolarHBondContact N-O 2.84Å; I372-T410 PolarHBondContact O-N 2.77Å; I372-M412 HydrophobicContact CD1-CE 3.96Å
373	T	93.4	Very high	90.5	Very high	10 Å²	10	39.2 Å²	39.2	6%	0.061	26%	0.256	C	S	.	.			trans	-75	161.9	176.1	58	0	0	0	0	111.8	N375 G376 S377 M379 Y409	T373-N375 PolarHBondContact O-N 2.83Å; T373-N375 VanDerWaalsContact O-N 3.07Å; T373-G376 PolarHBondContact O-N 3.02Å; T373-S377 WeakPolarHBondContact CB-O 3.4Å; T373-S377 PolarHBondContact N-O 2.96Å; T373-S377 WeakPolarHBondContact OG1-CA 3.22Å; T373-S377 PolarHBondContact OG1-N 2.78Å; T373-S377 VanDerWaalsContact OG1-N 3.11Å; T373-S377 PolarHBondContact OG1-O 2.95Å; T373-S377 PolarHBondContact OG1-OG 3.01Å; T373-M379 HydrophobicContact CG2-CG 4.26Å; T373-M379 HydrophobicContact CG2-SD 3.73Å; T373-Y409 HydrophobicContact CG2-CD1 4.43Å; T373-Y409 HydrophobicContact CG2-CE1 4.04Å
374	P	93	Very high	89.7	Confident	54 Å²	54	43.3 Å²	43.3	35%	0.351	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-30.8	175.7	-26.3	32.5	0	0	0	113.8	G376 L408 Y409	P374-G376 PolarHBondContact O-N 3.06Å; P374-L408 WeakPolarHBondContact CG-O 3.02Å; P374-Y409 VanDerWaalsContact CD-CZ 3.47Å; P374-Y409 HydrophobicContact CG-CD2 4Å; P374-Y409 HydrophobicContact CG-CE2 3.63Å
375	N	90.6	Very high	89.5	Confident	146 Å²	146	47.1 Å²	47.1	78%	0.781	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	11.1	177.6	-62.1	-29.7	0	0	0	113.7	T373 S377	T373-N375 PolarHBondContact O-N 2.83Å; T373-N375 VanDerWaalsContact O-N 3.07Å; N375-S377 PolarHBondContact O-N 3.19Å; N375-S377 VanDerWaalsContact O-N 3.12Å
376	G	90.3	Very high	89.2	Confident	52 Å²	52	48.6 Å²	48.6	54%	0.536	28%	0.276	S	S	.	.	S	Bend	trans	71.7	-3.7	-177.3	0	0	0	0	0	115.5	T373 P374	T373-G376 PolarHBondContact O-N 3.02Å; P374-G376 PolarHBondContact O-N 3.06Å
377	S	91.4	Very high	89.3	Confident	40 Å²	40	51.3 Å²	51.3	28%	0.28	28%	0.284	S	S	.	.			trans	-73.9	136.5	178.1	80.5	0	0	0	0	111.2	T373 N375	T373-S377 WeakPolarHBondContact CB-O 3.4Å; T373-S377 PolarHBondContact N-O 2.96Å; T373-S377 WeakPolarHBondContact OG1-CA 3.22Å; T373-S377 PolarHBondContact OG1-N 2.78Å; T373-S377 VanDerWaalsContact OG1-N 3.11Å; T373-S377 PolarHBondContact OG1-O 2.95Å; T373-S377 PolarHBondContact OG1-OG 3.01Å; N375-S377 PolarHBondContact O-N 3.19Å; N375-S377 VanDerWaalsContact O-N 3.12Å
378	V	91.8	Very high	89.3	Confident	88 Å²	88	52 Å²	52	53%	0.533	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	140.3	-179.7	-174	0	0	0	0	110.3	W371 I372	W371-V378 CarbonylContact O-C 3.39Å; W371-V378 WeakPolarHBondContact O-CA 3.44Å; I372-V378 HydrophobicContact CG1-CG2 4.47Å
379	M	91.8	Very high	89.3	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	140.8	177.6	-69.4	-178.7	57.8	0	0	110.6	S370 W371 T373 R385 I388 V390 L396	S370-M379 CarbonylContact C-O 3.55Å; S370-M379 VanDerWaalsContact CA-O 3.3Å; S370-M379 WeakPolarHBondContact CA-O 3.06Å; W371-M379 HydrophobicContact CB-CB 4.38Å; W371-M379 PolarHBondContact N-O 3.37Å; W371-M379 PolarHBondContact O-N 2.73Å; T373-M379 HydrophobicContact CG2-CG 4.26Å; T373-M379 HydrophobicContact CG2-SD 3.73Å; M379-R385 PolarHBondContact SD-NH1 3.03Å; M379-R385 VanDerWaalsContact SD-NH1 3.43Å; M379-I388 HydrophobicContact CE-CB 3.89Å; M379-I388 HydrophobicContact CE-CG2 3.74Å; M379-I388 WeakPolarHBondContact CE-O 3.27Å; M379-I388 HydrophobicContact SD-CG2 4.35Å; M379-V390 HydrophobicContact CB-CG2 4.21Å; M379-L396 HydrophobicContact CE-CD1 4.23Å
380	T	92.1	Very high	89.3	Confident	36 Å²	36	53.1 Å²	53.1	22%	0.221	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	172.9	-179.7	67.9	0	0	0	0	110.5	G382 A383	T380-G382 PolarHBondContact O-N 2.91Å; T380-A383 WeakPolarHBondContact O-CB 3.27Å; T380-A383 PolarHBondContact O-N 2.95Å; T380-A383 VanDerWaalsContact O-N 3.1Å
381	H	89	Confident	89.2	Confident	30 Å²	30	55 Å²	55	14%	0.139	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.9	178.3	-172.7	-127.4	0	0	0	113.4	P222 E245 R246 N247 V390 S392	P222-H381 WeakPolarHBondContact CG-CE1 3.31Å; P222-H381 WeakPolarHBondContact CG-ND1 3.25Å; E245-H381 IonicContact OE2-CE1 3.46Å; E245-H381 PolarHBondContact OE2-CE1 3.32Å; R246-H381 HydrophobicContact CB-CB 3.95Å; R246-H381 PolarHBondContact O-ND1 3.18Å; N247-H381 HydrophobicContact CB-CB 4.31Å; N247-H381 PolarHBondContact OD1-N 2.87Å; H381-V390 PolarHBondContact CD2-O 2.79Å; H381-S392 PolarHBondContact CD2-N 3.16Å; H381-S392 WeakPolarHBondContact NE2-CA 3.47Å; H381-S392 WeakPolarHBondContact NE2-CB 3.48Å; H381-S392 PolarHBondContact NE2-N 3.2Å
382	G	83.4	Confident	88.8	Confident	10 Å²	10	58.1 Å²	58.1	10%	0.103	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.5	176.3	0	0	0	0	0	114.6	N247 T380 Y384	N247-G382 VanDerWaalsContact CB-N 3.28Å; T380-G382 PolarHBondContact O-N 2.91Å; G382-Y384 PolarHBondContact O-N 2.72Å; G382-Y384 VanDerWaalsContact O-N 3.1Å
383	A	84.3	Confident	88.6	Confident	34 Å²	34	57.8 Å²	57.8	28%	0.281	33%	0.326	S	S	.	.			trans	-76.1	100.2	-174.3	0	0	0	0	0	111.5	T380 R385	T380-A383 WeakPolarHBondContact O-CB 3.27Å; T380-A383 PolarHBondContact O-N 2.95Å; T380-A383 VanDerWaalsContact O-N 3.1Å; A383-R385 PolarHBondContact O-N 2.71Å
384	Y	71.7	Confident	88.5	Confident	160 Å²	160	57.3 Å²	57.3	63%	0.627	32%	0.323	S	S	*	.			trans	-66.8	98.4	179.6	-169.8	-94	0	0	0	112.1	G382 V386	G382-Y384 PolarHBondContact O-N 2.72Å; G382-Y384 VanDerWaalsContact O-N 3.1Å; Y384-V386 HydrophobicContact CE1-CG2 4.11Å
385	R	80.1	Confident	88.6	Confident	118 Å²	118	54.9 Å²	54.9	45%	0.445	31%	0.308	S	S	.	.			trans	-132.9	128.3	171.4	-77.3	-175.1	176.4	-171.4	2	109.3	M379 A383 R387 I388	M379-R385 PolarHBondContact SD-NH1 3.03Å; M379-R385 VanDerWaalsContact SD-NH1 3.43Å; A383-R385 PolarHBondContact O-N 2.71Å; R385-R387 PolarHBondContact O-N 3.29Å; R385-I388 WeakPolarHBondContact CB-O 3.43Å
386	V	78.4	Confident	88.8	Confident	120 Å²	120	48 Å²	48	73%	0.727	27%	0.271	S	S	*	.	S	Bend	trans	-73.1	-25.8	-168.5	-173.2	0	0	0	0	113.5	Y384	Y384-V386 HydrophobicContact CE1-CG2 4.11Å
387	R	90.3	Very high	89	Confident	82 Å²	82	47.2 Å²	47.2	31%	0.309	25%	0.254	S	S	.	.	S	Bend	trans	-105.8	-29.9	-172.3	-166.6	175.6	66	73	-5.1	114.8	R385 F398 T399 K400 D405	R385-R387 PolarHBondContact O-N 3.29Å; R387-F398 WeakPolarHBondContact O-CA 3.43Å; R387-T399 WeakPolarHBondContact CA-OG1 3.46Å; R387-T399 PolarHBondContact O-N 3.36Å; R387-T399 PolarHBondContact O-OG1 3.09Å; R387-K400 VanDerWaalsContact CD-O 3.28Å; R387-K400 WeakPolarHBondContact CD-O 3.34Å; R387-K400 HydrophobicContact CG-CB 4.49Å; R387-K400 VanDerWaalsContact CG-O 3.28Å; R387-K400 WeakPolarHBondContact CG-O 3.29Å; R387-K400 PolarHBondContact NH1-O 3.28Å; R387-D405 IonicContact CZ-OD1 3.9Å; R387-D405 IonicContact CZ-OD2 2.73Å; R387-D405 IonicContact NH1-OD1 3.16Å; R387-D405 PolarHBondContact NH1-OD1 2.78Å; R387-D405 IonicContact NH1-OD2 2.67Å; R387-D405 PolarHBondContact NH1-OD2 3.43Å; R387-D405 IonicContact NH2-OD1 2.79Å; R387-D405 PolarHBondContact NH2-OD1 3.4Å; R387-D405 IonicContact NH2-OD2 3.76Å; R387-D405 PolarHBondContact NH2-OD2 2.82Å
388	I	91.4	Very high	89.2	Confident	15 Å²	15	45.3 Å²	45.3	8%	0.077	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.4	-179.4	-45.6	175.6	0	0	0	106.4	M379 R385 L396 N397 F398	M379-I388 HydrophobicContact CE-CB 3.89Å; M379-I388 HydrophobicContact CE-CG2 3.74Å; M379-I388 WeakPolarHBondContact CE-O 3.27Å; M379-I388 HydrophobicContact SD-CG2 4.35Å; R385-I388 WeakPolarHBondContact CB-O 3.43Å; I388-L396 HydrophobicContact CG2-CD1 3.74Å; I388-L396 HydrophobicContact CG2-CD2 4.44Å; I388-L396 HydrophobicContact CG2-CG 4.04Å; I388-N397 CarbonylContact C-O 3.42Å; I388-N397 WeakPolarHBondContact CA-O 3.45Å; I388-F398 HydrophobicContact CB-CD1 4.41Å; I388-F398 HydrophobicContact CD1-CD1 3.89Å; I388-F398 HydrophobicContact CD1-CE1 3.7Å; I388-F398 HydrophobicContact CG1-CD1 3.71Å; I388-F398 HydrophobicContact CG1-CE1 4Å; I388-F398 HydrophobicContact CG1-CG 4.48Å; I388-F398 HydrophobicContact CG2-CD1 3.97Å; I388-F398 HydrophobicContact CG2-CD2 4.46Å; I388-F398 HydrophobicContact CG2-CE1 3.89Å; I388-F398 HydrophobicContact CG2-CE2 4.37Å; I388-F398 HydrophobicContact CG2-CG 4.25Å; I388-F398 HydrophobicContact CG2-CZ 4.09Å
389	A	92.4	Very high	89.3	Confident	37 Å²	37	45.4 Å²	45.4	31%	0.306	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	147.6	-178.1	0	0	0	0	0	110.8	N397	A389-N397 PolarHBondContact N-O 3.48Å; A389-N397 PolarHBondContact O-N 3.08Å
390	V	93.6	Very high	89.3	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.055	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	137.3	167.2	-174	0	0	0	0	107.6	W371 M379 H381 T395 L396	W371-V390 HydrophobicContact CB-CG2 4.47Å; W371-V390 HydrophobicContact CG-CG2 4.41Å; M379-V390 HydrophobicContact CB-CG2 4.21Å; H381-V390 PolarHBondContact CD2-O 2.79Å; V390-T395 CarbonylContact C-O 3.51Å; V390-L396 HydrophobicContact CG2-CD1 3.9Å
391	L	91.8	Very high	89.4	Confident	61 Å²	61	49.2 Å²	49.2	32%	0.319	26%	0.255	S	S	.	.			trans	-92.4	164.8	176	-59.4	-177.2	0	0	0	111.5	D393 G394 T395 N397	L391-D393 PolarHBondContact O-N 2.73Å; L391-G394 PolarHBondContact O-N 2.92Å; L391-T395 HydrophobicContact CD1-CG2 4.38Å; L391-T395 PolarHBondContact N-O 3.45Å; L391-N397 HydrophobicContact CD1-CB 4.05Å; L391-N397 HydrophobicContact CD2-CB 4.18Å; L391-N397 HydrophobicContact CG-CB 3.97Å
392	S	88.9	Confident	89.6	Confident	66 Å²	66	49.3 Å²	49.3	46%	0.462	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.9	-173.9	58.4	0	0	0	0	114	R246 H381	R246-S392 PolarHBondContact NH1-O 2.65Å; H381-S392 PolarHBondContact CD2-N 3.16Å; H381-S392 WeakPolarHBondContact NE2-CA 3.47Å; H381-S392 WeakPolarHBondContact NE2-CB 3.48Å; H381-S392 PolarHBondContact NE2-N 3.2Å
393	D	90.5	Very high	89.9	Confident	43 Å²	43	51.7 Å²	51.7	23%	0.23	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-22.1	173.8	73	-13.8	0	0	0	113.6	R246 R361 L391 T395	R246-D393 PolarHBondContact NH1-O 2.72Å; R361-D393 HydrophobicContact CG-CB 4.37Å; R361-D393 IonicContact CZ-OD2 3.9Å; R361-D393 IonicContact NE-OD2 3.16Å; R361-D393 PolarHBondContact NE-OD2 3.33Å; R361-D393 IonicContact NH2-OD2 2.72Å; R361-D393 PolarHBondContact NH2-OD2 3.26Å; L391-D393 PolarHBondContact O-N 2.73Å; D393-T395 WeakPolarHBondContact OD1-CB 3.39Å; D393-T395 PolarHBondContact OD1-N 2.8Å; D393-T395 PolarHBondContact OD1-OG1 2.77Å; D393-T395 PolarHBondContact OD2-OG1 2.8Å; D393-T395 VanDerWaalsContact OD2-OG1 3.09Å
394	G	92.1	Very high	90.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.298	C	S	.	.	S	Bend	trans	115.2	-5.6	-178.1	0	0	0	0	0	114.5	C360 W371 L391	C360-G394 CarbonylContact O-C 3.6Å; C360-G394 WeakPolarHBondContact O-CA 3.35Å; W371-G394 PolarHBondContact NE1-O 3.24Å; L391-G394 PolarHBondContact O-N 2.92Å
395	T	94.6	Very high	91.3	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.025	27%	0.271	C	S	.	.			trans	-66.6	136.3	178.2	-59.1	0	0	0	0	111.7	E357 M358 K359 V390 L391 D393	E357-T395 HydrophobicContact CB-CG2 4.01Å; E357-T395 HydrophobicContact CG-CG2 4.49Å; M358-T395 WeakPolarHBondContact O-CA 3.37Å; K359-T395 HydrophobicContact CG-CG2 4.48Å; V390-T395 CarbonylContact C-O 3.51Å; L391-T395 HydrophobicContact CD1-CG2 4.38Å; L391-T395 PolarHBondContact N-O 3.45Å; D393-T395 WeakPolarHBondContact OD1-CB 3.39Å; D393-T395 PolarHBondContact OD1-N 2.8Å; D393-T395 PolarHBondContact OD1-OG1 2.77Å; D393-T395 PolarHBondContact OD2-OG1 2.8Å; D393-T395 VanDerWaalsContact OD2-OG1 3.09Å
396	L	95.4	Very high	92	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.9	171.7	-173.1	70.6	0	0	0	109.5	E357 M358 W371 M379 I388 V390 F398 Y409	E357-L396 CarbonylContact C-O 3.55Å; E357-L396 WeakPolarHBondContact CA-O 3.28Å; M358-L396 HydrophobicContact CB-CB 4.32Å; M358-L396 PolarHBondContact N-O 2.9Å; M358-L396 PolarHBondContact O-N 2.78Å; W371-L396 HydrophobicContact CB-CD1 4.28Å; W371-L396 HydrophobicContact CD2-CB 3.91Å; W371-L396 HydrophobicContact CD2-CD2 4.02Å; W371-L396 HydrophobicContact CD2-CG 4.41Å; W371-L396 HydrophobicContact CE3-CB 4.48Å; W371-L396 HydrophobicContact CE3-CD2 4Å; W371-L396 HydrophobicContact CG-CB 4.19Å; W371-L396 HydrophobicContact CG-CD1 4.14Å; W371-L396 HydrophobicContact CG-CD2 4.28Å; W371-L396 HydrophobicContact CG-CG 4.46Å; W371-L396 HydrophobicContact CH2-CB 4.41Å; W371-L396 HydrophobicContact CZ2-CB 3.86Å; W371-L396 HydrophobicContact CZ3-CD2 4.46Å; M379-L396 HydrophobicContact CE-CD1 4.23Å; I388-L396 HydrophobicContact CG2-CD1 3.74Å; I388-L396 HydrophobicContact CG2-CD2 4.44Å; I388-L396 HydrophobicContact CG2-CG 4.04Å; V390-L396 HydrophobicContact CG2-CD1 3.9Å; L396-F398 HydrophobicContact CD2-CE2 3.67Å; L396-F398 HydrophobicContact CD2-CZ 3.75Å; L396-F398 HydrophobicContact CG-CD2 4.5Å; L396-F398 HydrophobicContact CG-CE2 3.8Å; L396-F398 HydrophobicContact CG-CZ 4.26Å; L396-Y409 HydrophobicContact CD2-CD1 3.57Å; L396-Y409 HydrophobicContact CD2-CE1 3.91Å; L396-Y409 HydrophobicContact CD2-CG 4.4Å
397	N	95.2	Very high	92.8	Very high	36 Å²	36	44.2 Å²	44.2	19%	0.193	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132.4	-177.2	-178.3	-16.1	0	0	0	110.5	I388 A389 L391	I388-N397 CarbonylContact C-O 3.42Å; I388-N397 WeakPolarHBondContact CA-O 3.45Å; A389-N397 PolarHBondContact N-O 3.48Å; A389-N397 PolarHBondContact O-N 3.08Å; L391-N397 HydrophobicContact CD1-CB 4.05Å; L391-N397 HydrophobicContact CD2-CB 4.18Å; L391-N397 HydrophobicContact CG-CB 3.97Å
398	F	94.7	Very high	93.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.2	174.6	-61.3	-111.3	0	0	0	108.9	A355 A356 M358 R387 I388 L396 K400 V401 D405 Y409 L426	A355-F398 WeakPolarHBondContact CA-O 3.39Å; A355-F398 WeakPolarHBondContact CB-O 3.27Å; A356-F398 HydrophobicContact CB-CB 4.25Å; A356-F398 HydrophobicContact CB-CD2 4.29Å; A356-F398 PolarHBondContact N-O 2.79Å; A356-F398 VanDerWaalsContact N-O 3.07Å; A356-F398 PolarHBondContact O-N 2.82Å; M358-F398 HydrophobicContact CG-CE2 4.32Å; M358-F398 HydrophobicContact SD-CE2 4.24Å; R387-F398 WeakPolarHBondContact O-CA 3.43Å; I388-F398 HydrophobicContact CB-CD1 4.41Å; I388-F398 HydrophobicContact CD1-CD1 3.89Å; I388-F398 HydrophobicContact CD1-CE1 3.7Å; I388-F398 HydrophobicContact CG1-CD1 3.71Å; I388-F398 HydrophobicContact CG1-CE1 4Å; I388-F398 HydrophobicContact CG1-CG 4.48Å; I388-F398 HydrophobicContact CG2-CD1 3.97Å; I388-F398 HydrophobicContact CG2-CD2 4.46Å; I388-F398 HydrophobicContact CG2-CE1 3.89Å; I388-F398 HydrophobicContact CG2-CE2 4.37Å; I388-F398 HydrophobicContact CG2-CG 4.25Å; I388-F398 HydrophobicContact CG2-CZ 4.09Å; L396-F398 HydrophobicContact CD2-CE2 3.67Å; L396-F398 HydrophobicContact CD2-CZ 3.75Å; L396-F398 HydrophobicContact CG-CD2 4.5Å; L396-F398 HydrophobicContact CG-CE2 3.8Å; L396-F398 HydrophobicContact CG-CZ 4.26Å; F398-K400 VanDerWaalsContact C-N 3.34Å; F398-V401 HydrophobicContact CB-CG2 3.62Å; F398-V401 HydrophobicContact CD1-CG2 4.25Å; F398-V401 HydrophobicContact CG-CG2 4.08Å; F398-D405 HydrophobicContact CE1-CB 4.22Å; F398-Y409 HydrophobicContact CE1-CE1 4.35Å; F398-Y409 HydrophobicContact CZ-CD1 4.46Å; F398-Y409 AromaticContact CZ-CE1 3.79Å; F398-Y409 HydrophobicContact CZ-CE1 3.79Å; F398-Y409 HydrophobicContact CZ-CE2 4.34Å; F398-Y409 AromaticContact CZ-CZ 3.73Å; F398-L426 HydrophobicContact CD1-CD2 4.34Å; F398-L426 HydrophobicContact CE1-CD2 3.72Å; F398-L426 HydrophobicContact CE2-CD2 4.14Å; F398-L426 HydrophobicContact CZ-CD2 3.62Å
399	T	92.9	Very high	93.4	Very high	90 Å²	90	44.3 Å²	44.3	55%	0.552	25%	0.249	S	C	*	.	S	Bend	trans	-74	-28	178.6	58.5	0	0	0	0	112.6	R387	R387-T399 WeakPolarHBondContact CA-OG1 3.46Å; R387-T399 PolarHBondContact O-N 3.36Å; R387-T399 PolarHBondContact O-OG1 3.09Å
400	K	92.3	Very high	93.6	Very high	118 Å²	118	43.8 Å²	43.8	51%	0.513	24%	0.242	S	C	.	.	S	Bend	trans	-150.3	118.4	168.4	-168.9	-180	-177.1	-177.8	0	109.6	R387 F398	R387-K400 VanDerWaalsContact CD-O 3.28Å; R387-K400 WeakPolarHBondContact CD-O 3.34Å; R387-K400 HydrophobicContact CG-CB 4.49Å; R387-K400 VanDerWaalsContact CG-O 3.28Å; R387-K400 WeakPolarHBondContact CG-O 3.29Å; R387-K400 PolarHBondContact NH1-O 3.28Å; F398-K400 VanDerWaalsContact C-N 3.34Å
401	V	93.8	Very high	93.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.239	C	C	.	.			trans	-82.5	145.2	175.8	-176.2	0	0	0	0	110.4	V350 G353 M354 A356 F398 D405 L426 V428	V350-V401 HydrophobicContact CG1-CG2 4.41Å; G353-V401 PolarHBondContact N-O 3.4Å; M354-V401 WeakPolarHBondContact O-CG2 3.35Å; M354-V401 PolarHBondContact O-N 3.26Å; A356-V401 HydrophobicContact CB-CG2 3.57Å; F398-V401 HydrophobicContact CB-CG2 3.62Å; F398-V401 HydrophobicContact CD1-CG2 4.25Å; F398-V401 HydrophobicContact CG-CG2 4.08Å; V401-D405 HydrophobicContact CG1-CB 4.31Å; V401-L426 HydrophobicContact CG1-CD2 4.38Å; V401-V428 HydrophobicContact CG1-CB 4.19Å; V401-V428 HydrophobicContact CG1-CG1 3.72Å; V401-V428 HydrophobicContact CG1-CG2 3.35Å
402	T	92.9	Very high	94	Very high	32 Å²	32	43 Å²	43	20%	0.196	24%	0.237	C	C	.	.			trans	-128.2	156.4	176.3	62	0	0	0	0	110.3	E352 Q404 D405	E352-T402 VanDerWaalsContact OE1-CA 3.26Å; E352-T402 WeakPolarHBondContact OE1-CA 3.11Å; T402-Q404 PolarHBondContact O-N 2.82Å; T402-D405 PolarHBondContact N-OD2 3.21Å; T402-D405 WeakPolarHBondContact O-CB 2.98Å; T402-D405 PolarHBondContact O-N 2.77Å; T402-D405 PolarHBondContact OG1-OD2 2.8Å
403	V	91.6	Very high	94.3	Very high	61 Å²	61	39.9 Å²	39.9	37%	0.37	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-55.7	-31	-178.7	179.8	0	0	0	0	112.7	E352 D405 T406 V428 A430	E352-V403 HydrophobicContact CB-CG2 4.36Å; E352-V403 PolarHBondContact OE1-N 3.4Å; V403-D405 PolarHBondContact O-N 2.85Å; V403-T406 WeakPolarHBondContact O-CB 3.45Å; V403-T406 PolarHBondContact O-N 2.03Å; V403-T406 PolarHBondContact O-OG1 2.82Å; V403-V428 HydrophobicContact CG2-CG1 4.4Å; V403-A430 HydrophobicContact CG2-CB 3.97Å
404	Q	91.3	Very high	94.5	Very high	182 Å²	182	38.7 Å²	38.7	85%	0.85	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-68.6	-11.3	176.9	-64	-177.2	-7	0	0	115	T402 T406	T402-Q404 PolarHBondContact O-N 2.82Å; Q404-T406 VanDerWaalsContact C-N 3.26Å
405	D	92.7	Very high	94.5	Very high	10 Å²	10	39.6 Å²	39.6	5%	0.053	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-81.2	-5.6	173.1	-59.9	-55.2	0	0	0	112.7	R387 F398 V401 T402 V403 G407 Y409 L426 V428	R387-D405 IonicContact CZ-OD1 3.9Å; R387-D405 IonicContact CZ-OD2 2.73Å; R387-D405 IonicContact NH1-OD1 3.16Å; R387-D405 PolarHBondContact NH1-OD1 2.78Å; R387-D405 IonicContact NH1-OD2 2.67Å; R387-D405 PolarHBondContact NH1-OD2 3.43Å; R387-D405 IonicContact NH2-OD1 2.79Å; R387-D405 PolarHBondContact NH2-OD1 3.4Å; R387-D405 IonicContact NH2-OD2 3.76Å; R387-D405 PolarHBondContact NH2-OD2 2.82Å; F398-D405 HydrophobicContact CE1-CB 4.22Å; V401-D405 HydrophobicContact CG1-CB 4.31Å; T402-D405 PolarHBondContact N-OD2 3.21Å; T402-D405 WeakPolarHBondContact O-CB 2.98Å; T402-D405 PolarHBondContact O-N 2.77Å; T402-D405 PolarHBondContact OG1-OD2 2.8Å; V403-D405 PolarHBondContact O-N 2.85Å; D405-G407 PolarHBondContact O-N 2.04Å; D405-Y409 VanDerWaalsContact O-CE2 3.27Å; D405-Y409 WeakPolarHBondContact O-CE2 3.07Å; D405-Y409 PolarHBondContact O-OH 3.02Å; D405-Y409 VanDerWaalsContact O-OH 3.06Å; D405-L426 HydrophobicContact CB-CD2 4.09Å; D405-V428 HydrophobicContact CB-CG2 4.48Å
406	T	94.9	Very high	94.2	Very high	62 Å²	62	39.9 Å²	39.9	38%	0.38	22%	0.217	S	C	.	.			trans	-61.6	127.3	-179.2	-61.3	0	0	0	0	111.7	V403 Q404 L426 V428	V403-T406 WeakPolarHBondContact O-CB 3.45Å; V403-T406 PolarHBondContact O-N 2.03Å; V403-T406 PolarHBondContact O-OG1 2.82Å; Q404-T406 VanDerWaalsContact C-N 3.26Å; T406-L426 CarbonylContact C-O 3.34Å; T406-L426 WeakPolarHBondContact CA-O 3.07Å; T406-V428 WeakPolarHBondContact OG1-CB 2.98Å; T406-V428 PolarHBondContact OG1-N 2.7Å
407	G	95.8	Very high	93.9	Very high	20 Å²	20	43.1 Å²	43.1	21%	0.206	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.4	-172	174.4	0	0	0	0	0	114.9	D405 T425 L426	D405-G407 PolarHBondContact O-N 2.04Å; G407-T425 WeakPolarHBondContact O-CA 3.45Å; G407-L426 PolarHBondContact N-O 2.82Å; G407-L426 PolarHBondContact O-N 3.06Å
408	L	96.8	Very high	93.7	Very high	93 Å²	93	42.4 Å²	42.4	49%	0.487	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	121	178.1	-174.7	70	0	0	0	111.2	P374 T425	P374-L408 WeakPolarHBondContact CG-O 3.02Å; L408-T425 HydrophobicContact CB-CG2 4.48Å; L408-T425 HydrophobicContact CD1-CG2 3.8Å
409	Y	97.3	Very high	93.7	Very high	7 Å²	7	47.3 Å²	47.3	3%	0.027	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	133.1	171.1	-70.3	-104	0	0	0	109.5	M358 I372 T373 P374 L396 F398 D405 S423 A424 L426	M358-Y409 HydrophobicContact CE-CG 4.48Å; M358-Y409 HydrophobicContact SD-CD2 4.06Å; M358-Y409 HydrophobicContact SD-CG 4.04Å; I372-Y409 WeakPolarHBondContact O-CA 3.36Å; T373-Y409 HydrophobicContact CG2-CD1 4.43Å; T373-Y409 HydrophobicContact CG2-CE1 4.04Å; P374-Y409 VanDerWaalsContact CD-CZ 3.47Å; P374-Y409 HydrophobicContact CG-CD2 4Å; P374-Y409 HydrophobicContact CG-CE2 3.63Å; L396-Y409 HydrophobicContact CD2-CD1 3.57Å; L396-Y409 HydrophobicContact CD2-CE1 3.91Å; L396-Y409 HydrophobicContact CD2-CG 4.4Å; F398-Y409 HydrophobicContact CE1-CE1 4.35Å; F398-Y409 HydrophobicContact CZ-CD1 4.46Å; F398-Y409 AromaticContact CZ-CE1 3.79Å; F398-Y409 HydrophobicContact CZ-CE1 3.79Å; F398-Y409 HydrophobicContact CZ-CE2 4.34Å; F398-Y409 AromaticContact CZ-CZ 3.73Å; D405-Y409 VanDerWaalsContact O-CE2 3.27Å; D405-Y409 WeakPolarHBondContact O-CE2 3.07Å; D405-Y409 PolarHBondContact O-OH 3.02Å; D405-Y409 VanDerWaalsContact O-OH 3.06Å; Y409-S423 VanDerWaalsContact O-CA 3.27Å; Y409-S423 WeakPolarHBondContact O-CA 3.44Å; Y409-A424 PolarHBondContact N-O 2.99Å; Y409-A424 PolarHBondContact O-N 3.26Å; Y409-L426 HydrophobicContact CD2-CB 4.02Å; Y409-L426 HydrophobicContact CE2-CB 3.86Å; Y409-L426 HydrophobicContact CE2-CD2 4.09Å
410	T	97.3	Very high	93.8	Very high	26 Å²	26	45.1 Å²	45.1	16%	0.16	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	117.4	177.3	-61.2	0	0	0	0	110.2	I372 T421 S423	I372-T410 PolarHBondContact N-O 2.84Å; I372-T410 PolarHBondContact O-N 2.77Å; T410-T421 HydrophobicContact CG2-CG2 4.21Å; T410-S423 WeakPolarHBondContact CB-OG 3.49Å; T410-S423 WeakPolarHBondContact CG2-OG 3.46Å; T410-S423 WeakPolarHBondContact OG1-CB 3.31Å; T410-S423 PolarHBondContact OG1-OG 2.86Å
411	C	97.2	Very high	94	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.5	165.1	-177.1	0	0	0	0	109.3	C360 W371 T421 A422	C360-C411 HydrophobicContact CB-CB 3.64Å; C360-C411 WeakPolarHBondContact CB-SG 3.04Å; C360-C411 WeakPolarHBondContact SG-CB 3.06Å; C360-C411 CovalentContact SG-SG 2.02Å; C360-C411 PolarHBondContact SG-SG 2.89Å; W371-C411 HydrophobicContact CD2-CB 4.04Å; W371-C411 HydrophobicContact CE3-CB 4.05Å; W371-C411 HydrophobicContact CH2-CB 3.9Å; W371-C411 HydrophobicContact CZ2-CB 3.84Å; W371-C411 HydrophobicContact CZ3-CB 3.98Å; C411-T421 VanDerWaalsContact O-CA 3.25Å; C411-T421 WeakPolarHBondContact O-CA 3.24Å; C411-A422 PolarHBondContact N-O 3.18Å; C411-A422 PolarHBondContact O-N 3.09Å
412	M	95.5	Very high	94.1	Very high	54 Å²	54	44.3 Å²	44.3	27%	0.266	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.3	172.9	-179	176.9	-70.7	0	0	109.2	S370 I372 T421	S370-M412 PolarHBondContact N-O 3.44Å; S370-M412 PolarHBondContact O-N 3.37Å; S370-M412 PolarHBondContact OG-O 2.94Å; I372-M412 HydrophobicContact CD1-CE 3.96Å; M412-T421 HydrophobicContact CB-CG2 3.96Å; M412-T421 HydrophobicContact CE-CG2 3.7Å; M412-T421 HydrophobicContact CG-CG2 3.9Å
413	V	95.7	Very high	94.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.6	177.8	-175.1	0	0	0	0	108.6	P339 I341 A362 T367 S368 V369 N419 T420	P339-V413 HydrophobicContact CB-CG1 3.86Å; P339-V413 HydrophobicContact CG-CB 4.46Å; P339-V413 HydrophobicContact CG-CG1 4.13Å; P339-V413 WeakPolarHBondContact CG-O 3.5Å; I341-V413 HydrophobicContact CD1-CG2 3.95Å; I341-V413 HydrophobicContact CG1-CB 4.36Å; I341-V413 HydrophobicContact CG1-CG2 3.84Å; A362-V413 HydrophobicContact CB-CG1 3.66Å; T367-V413 HydrophobicContact CG2-CG1 3.84Å; S368-V413 WeakPolarHBondContact O-CA 3.34Å; V369-V413 HydrophobicContact CG2-CG1 4.29Å; V369-V413 HydrophobicContact CG2-CG2 4.15Å; V413-N419 CarbonylContact O-C 3.58Å; V413-N419 WeakPolarHBondContact O-CA 3.29Å; V413-T420 PolarHBondContact N-O 3.15Å; V413-T420 PolarHBondContact O-N 3.42Å
414	S	93.8	Very high	94.6	Very high	17 Å²	17	42.9 Å²	42.9	12%	0.119	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151.8	179.2	52.2	0	0	0	0	112.9	T367 S368 G418 N419	T367-S414 WeakPolarHBondContact CA-O 3.46Å; T367-S414 WeakPolarHBondContact CB-O 3.28Å; S368-S414 PolarHBondContact N-O 3Å; S368-S414 VanDerWaalsContact N-O 3.09Å; S368-S414 PolarHBondContact O-N 2.98Å; S368-S414 PolarHBondContact OG-O 2.82Å; S368-S414 PolarHBondContact OG-OG 3.46Å; S414-G418 WeakPolarHBondContact CA-O 3.47Å; S414-N419 WeakPolarHBondContact CB-OD1 3.45Å
415	N	92.8	Very high	94.9	Very high	19 Å²	19	37.1 Å²	37.1	10%	0.102	23%	0.229	C	C	.	.			trans	-139.8	-174.8	170.1	77.5	-2.8	0	0	0	110.3	H270 Y337 P339 T367 V417 G418	H270-N415 PolarHBondContact NE2-O 2.84Å; Y337-N415 PolarHBondContact O-ND2 3.13Å; P339-N415 HydrophobicContact CB-CB 4.34Å; P339-N415 HydrophobicContact CG-CB 4.5Å; T367-N415 HydrophobicContact CG2-CB 4.24Å; N415-V417 PolarHBondContact O-N 3.45Å; N415-V417 WeakPolarHBondContact OD1-CA 3.23Å; N415-V417 WeakPolarHBondContact OD1-CB 3.25Å; N415-V417 PolarHBondContact OD1-N 3.37Å; N415-G418 PolarHBondContact N-O 2.92Å; N415-G418 PolarHBondContact O-N 3.46Å; N415-G418 PolarHBondContact OD1-N 3.46Å; N415-G418 PolarHBondContact OD1-O 3.19Å
416	S	88.9	Confident	95.1	Very high	11 Å²	11	36.7 Å²	36.7	8%	0.077	23%	0.227	C	C	.	.	S	Bend	trans	-63	-4	-179.5	49.2	0	0	0	0	115.4	H270 C292 W299	H270-S416 PolarHBondContact CD2-N 2.81Å; H270-S416 WeakPolarHBondContact NE2-CA 3.11Å; H270-S416 PolarHBondContact NE2-N 3.11Å; H270-S416 VanDerWaalsContact NE2-N 3.2Å; C292-S416 PolarHBondContact O-OG 3.18Å; W299-S416 WeakPolarHBondContact CH2-O 3.5Å; W299-S416 VanDerWaalsContact CZ3-O 3.25Å; W299-S416 WeakPolarHBondContact CZ3-O 3.48Å
417	V	88.6	Confident	95.1	Very high	67 Å²	67	37 Å²	37	41%	0.406	23%	0.226	S	C	.	.	S	Bend	trans	-114.5	-33	-178.4	-169.2	0	0	0	0	111.9	C336 N415	C336-V417 HydrophobicContact CB-CG2 3.4Å; C336-V417 VanDerWaalsContact CB-CG2 3.4Å; N415-V417 PolarHBondContact O-N 3.45Å; N415-V417 WeakPolarHBondContact OD1-CA 3.23Å; N415-V417 WeakPolarHBondContact OD1-CB 3.25Å; N415-V417 PolarHBondContact OD1-N 3.37Å
418	G	90.7	Very high	95.1	Very high	22 Å²	22	36.4 Å²	36.4	23%	0.227	22%	0.218	C	C	.	.			trans	169	-166.9	-179.6	0	0	0	0	0	114.3	P339 S414 N415	P339-G418 WeakPolarHBondContact CD-O 3.19Å; S414-G418 WeakPolarHBondContact CA-O 3.47Å; N415-G418 PolarHBondContact N-O 2.92Å; N415-G418 PolarHBondContact O-N 3.46Å; N415-G418 PolarHBondContact OD1-N 3.46Å; N415-G418 PolarHBondContact OD1-O 3.19Å
419	N	94.3	Very high	94.8	Very high	103 Å²	103	35.3 Å²	35.3	55%	0.551	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122	142.9	-170.3	-58.5	-1.4	0	0	0	110.9	V413 S414	V413-N419 CarbonylContact O-C 3.58Å; V413-N419 WeakPolarHBondContact O-CA 3.29Å; S414-N419 WeakPolarHBondContact CB-OD1 3.45Å
420	T	95.6	Very high	94.3	Very high	44 Å²	44	37.5 Å²	37.5	27%	0.27	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.5	174.3	-58.5	0	0	0	0	109	P339 I341 V413	P339-T420 VanDerWaalsContact O-CB 3.22Å; P339-T420 WeakPolarHBondContact O-CB 3.31Å; P339-T420 PolarHBondContact O-OG1 3.28Å; I341-T420 HydrophobicContact CD1-CG2 4.04Å; I341-T420 HydrophobicContact CG1-CG2 4.12Å; V413-T420 PolarHBondContact N-O 3.15Å; V413-T420 PolarHBondContact O-N 3.42Å
421	T	96.5	Very high	93.3	Very high	80 Å²	80	42.3 Å²	42.3	49%	0.491	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	144.7	-177.7	51.8	0	0	0	0	112.1	T410 C411 M412	T410-T421 HydrophobicContact CG2-CG2 4.21Å; C411-T421 VanDerWaalsContact O-CA 3.25Å; C411-T421 WeakPolarHBondContact O-CA 3.24Å; M412-T421 HydrophobicContact CB-CG2 3.96Å; M412-T421 HydrophobicContact CE-CG2 3.7Å; M412-T421 HydrophobicContact CG-CG2 3.9Å
422	A	96.9	Very high	91.7	Very high	20 Å²	20	49.7 Å²	49.7	17%	0.165	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	140.4	167.1	0	0	0	0	0	109.6	I341 P344 P345 C411	I341-A422 HydrophobicContact CD1-CB 3.72Å; P344-A422 HydrophobicContact CB-CB 4.12Å; P345-A422 HydrophobicContact CG-CB 4.35Å; C411-A422 PolarHBondContact N-O 3.18Å; C411-A422 PolarHBondContact O-N 3.09Å
423	S	97.3	Very high	89.8	Confident	60 Å²	60	53.3 Å²	53.3	42%	0.42	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	146.5	-173.5	-47.6	0	0	0	0	111.1	Y409 T410	Y409-S423 VanDerWaalsContact O-CA 3.27Å; Y409-S423 WeakPolarHBondContact O-CA 3.44Å; T410-S423 WeakPolarHBondContact CB-OG 3.49Å; T410-S423 WeakPolarHBondContact CG2-OG 3.46Å; T410-S423 WeakPolarHBondContact OG1-CB 3.31Å; T410-S423 PolarHBondContact OG1-OG 2.86Å
424	A	97.5	Very high	87.7	Confident	3 Å²	3	58.8 Å²	58.8	3%	0.025	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	159	173.2	0	0	0	0	0	110.5	P345 M358 Y409	P345-A424 HydrophobicContact CB-CB 3.81Å; P345-A424 HydrophobicContact CG-CB 4.12Å; M358-A424 HydrophobicContact CE-CB 3.79Å; Y409-A424 PolarHBondContact N-O 2.99Å; Y409-A424 PolarHBondContact O-N 3.26Å
425	T	97.1	Very high	85.5	Confident	61 Å²	61	60.6 Å²	60.6	37%	0.374	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.3	179.4	59.3	0	0	0	0	111.7	D347 L348 G407 L408	D347-T425 WeakPolarHBondContact CA-O 3.3Å; D347-T425 WeakPolarHBondContact OD1-CB 3.22Å; D347-T425 PolarHBondContact OD1-N 3.33Å; D347-T425 PolarHBondContact OD1-OG1 2.81Å; L348-T425 PolarHBondContact N-O 2.87Å; G407-T425 WeakPolarHBondContact O-CA 3.45Å; L408-T425 HydrophobicContact CB-CG2 4.48Å; L408-T425 HydrophobicContact CD1-CG2 3.8Å
426	L	96.5	Very high	83.6	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.005	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	126.3	165.3	179.7	63.7	0	0	0	107.5	L348 V350 M358 F398 V401 D405 T406 G407 Y409 V428	L348-L426 HydrophobicContact CB-CD1 4.21Å; L348-L426 HydrophobicContact CD2-CD1 4.17Å; L348-L426 HydrophobicContact CG-CD1 4.48Å; V350-L426 HydrophobicContact CG2-CD1 3.86Å; M358-L426 HydrophobicContact SD-CB 4.17Å; F398-L426 HydrophobicContact CD1-CD2 4.34Å; F398-L426 HydrophobicContact CE1-CD2 3.72Å; F398-L426 HydrophobicContact CE2-CD2 4.14Å; F398-L426 HydrophobicContact CZ-CD2 3.62Å; V401-L426 HydrophobicContact CG1-CD2 4.38Å; D405-L426 HydrophobicContact CB-CD2 4.09Å; T406-L426 CarbonylContact C-O 3.34Å; T406-L426 WeakPolarHBondContact CA-O 3.07Å; G407-L426 PolarHBondContact N-O 2.82Å; G407-L426 PolarHBondContact O-N 3.06Å; Y409-L426 HydrophobicContact CD2-CB 4.02Å; Y409-L426 HydrophobicContact CE2-CB 3.86Å; Y409-L426 HydrophobicContact CE2-CD2 4.09Å; L426-V428 HydrophobicContact CD2-CG2 4.41Å; L426-V428 HydrophobicContact CG-CG2 4.1Å
427	N	95.6	Very high	81.2	Confident	69 Å²	69	74 Å²	74	37%	0.369	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.1	-179.4	179.4	32.1	0	0	0	109.5	L348 N349 V350	L348-N427 PolarHBondContact O-N 2.83Å; N349-N427 WeakPolarHBondContact CA-O 3.44Å; N349-N427 WeakPolarHBondContact OD1-CB 3.37Å; N349-N427 PolarHBondContact OD1-ND2 3.36Å; V350-N427 PolarHBondContact N-O 2.78Å
428	V	94.6	Very high	79.3	Confident	8 Å²	8	80.6 Å²	80.6	5%	0.048	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	109.9	-169.9	-170.7	0	0	0	0	110.7	V350 E352 V401 V403 D405 T406 L426	V350-V428 CarbonylContact O-C 3.59Å; V350-V428 VanDerWaalsContact O-CA 3.26Å; V350-V428 WeakPolarHBondContact O-CA 3.47Å; E352-V428 HydrophobicContact CB-CG1 4.25Å; V401-V428 HydrophobicContact CG1-CB 4.19Å; V401-V428 HydrophobicContact CG1-CG1 3.72Å; V401-V428 HydrophobicContact CG1-CG2 3.35Å; V403-V428 HydrophobicContact CG2-CG1 4.4Å; D405-V428 HydrophobicContact CB-CG2 4.48Å; T406-V428 WeakPolarHBondContact OG1-CB 2.98Å; T406-V428 PolarHBondContact OG1-N 2.7Å; L426-V428 HydrophobicContact CD2-CG2 4.41Å; L426-V428 HydrophobicContact CG-CG2 4.1Å
429	T	92.2	Very high	77.1	Confident	69 Å²	69	88.1 Å²	88.1	42%	0.423	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128	173.2	47.1	0	0	0	0	110.2	V350 T351 E352	V350-T429 PolarHBondContact O-N 3.43Å; V350-T429 PolarHBondContact O-OG1 2.85Å; T351-T429 CarbonylContact C-O 3.59Å; T351-T429 WeakPolarHBondContact CA-O 3.08Å; T351-T429 WeakPolarHBondContact CG2-OG1 3.29Å; E352-T429 PolarHBondContact N-O 2.83Å
430	A	85.1	Confident	74.5	Confident	53 Å²	53	88.2 Å²	88.2	44%	0.438	49%	0.491	S	S	.	.			trans	-61	148.7	168.4	0	0	0	0	0	109.9	V403 D432	V403-A430 HydrophobicContact CG2-CB 3.97Å; A430-D432 PolarHBondContact O-N 2.89Å; A430-D432 VanDerWaalsContact O-N 3.09Å
431	L	76.7	Confident	72.1	Confident	127 Å²	127	92.1 Å²	92.1	67%	0.665	52%	0.516	S	S	*	.			trans	-72.5	98.6	160.5	-86.8	158.7	0	0	0	107.6	N433	L431-N433 VanDerWaalsContact C-N 3.29Å; L431-N433 PolarHBondContact O-N 2.83Å
432	D	64.3	Low	69.4	Low	155 Å²	155	94.3 Å²	94.3	83%	0.829	53%	0.529	S	S	*	.			trans	-57.6	98.2	164.6	-90.9	-24.2	0	0	0	108	A430 P434	A430-D432 PolarHBondContact O-N 2.89Å; A430-D432 VanDerWaalsContact O-N 3.09Å; D432-P434 VanDerWaalsContact O-CD 3.27Å; D432-P434 WeakPolarHBondContact O-CD 3.44Å
433	N	54.4	Low	66.7	Low	130 Å²	130	99.4 Å²	99.4	70%	0.695	56%	0.558	S	S	*	*			trans	-62	116.2	170.3	-176.7	28.3	0	0	0	106.8	L431 G435	L431-N433 VanDerWaalsContact C-N 3.29Å; L431-N433 PolarHBondContact O-N 2.83Å; N433-G435 VanDerWaalsContact C-N 3.26Å; N433-G435 PolarHBondContact O-N 3.45Å
434	P	53	Low	63.8	Low	115 Å²	115	102 Å²	102	75%	0.747	57%	0.57	S	S	*	*			trans	-67.2	92.2	179.7	27.6	-33.3	0	0	0	108.1	D432 Y436	D432-P434 VanDerWaalsContact O-CD 3.27Å; D432-P434 WeakPolarHBondContact O-CD 3.44Å; P434-Y436 PolarHBondContact O-N 3.33Å
435	G	46.1	Very low	60.9	Low	55 Å²	55	110.7 Å²	110.7	57%	0.567	61%	0.611	S	S	*	*			trans	-54.3	125.1	-173.4	0	0	0	0	0	109.8	N433 T437	N433-G435 VanDerWaalsContact C-N 3.26Å; N433-G435 PolarHBondContact O-N 3.45Å; G435-T437 PolarHBondContact O-N 2.88Å
436	Y	52.9	Low	57.9	Low	206 Å²	206	113.7 Å²	113.7	81%	0.808	63%	0.629	S	S	*	*			trans	-33.1	106.7	-171.4	-64.9	-89.6	0	0	0	112.3	P434 Y438	P434-Y436 PolarHBondContact O-N 3.33Å; Y436-Y438 VanDerWaalsContact O-CD1 3.28Å; Y436-Y438 WeakPolarHBondContact O-CD1 3.26Å; Y436-Y438 PolarHBondContact O-N 2.98Å
437	T	39.8	Very low	54.9	Low	107 Å²	107	120.1 Å²	120.1	66%	0.656	67%	0.668	S	S	*	*			trans	-66	100.7	171.9	41.9	0	0	0	0	107.7	G435 F439	G435-T437 PolarHBondContact O-N 2.88Å; T437-F439 VanDerWaalsContact O-CD2 3.22Å; T437-F439 WeakPolarHBondContact O-CD2 3.48Å; T437-F439 PolarHBondContact O-N 2.87Å
438	Y	48.8	Very low	51.8	Low	205 Å²	205	125.5 Å²	125.5	80%	0.804	69%	0.691	S	S	*	*			trans	-65.6	86.2	174.2	33.7	-90.4	0	0	0	108.8	Y436 S440	Y436-Y438 VanDerWaalsContact O-CD1 3.28Å; Y436-Y438 WeakPolarHBondContact O-CD1 3.26Å; Y436-Y438 PolarHBondContact O-N 2.98Å; Y438-S440 PolarHBondContact O-N 3.16Å
439	F	44.8	Very low	48.9	Very low	179 Å²	179	131 Å²	131	79%	0.785	73%	0.727	S	S	*	*			trans	-55.7	106.3	169.8	-75.4	-83	0	0	0	108.1	T437 T441	T437-F439 VanDerWaalsContact O-CD2 3.22Å; T437-F439 WeakPolarHBondContact O-CD2 3.48Å; T437-F439 PolarHBondContact O-N 2.87Å; F439-T441 PolarHBondContact O-N 2.7Å
440	S	39.8	Very low	45.9	Very low	105 Å²	105	132.7 Å²	132.7	73%	0.734	74%	0.742	S	S	*	*			trans	-69.6	102.5	-179.7	-62.2	0	0	0	0	108	Y438 V442	Y438-S440 PolarHBondContact O-N 3.16Å; S440-V442 PolarHBondContact O-N 3.24Å
441	T	45.4	Very low	43.4	Very low	127 Å²	127	138.8 Å²	138.8	78%	0.779	76%	0.761	S	S	*	*			trans	-68.3	98.8	-180	45.9	0	0	0	0	109.8	F439 T443	F439-T441 PolarHBondContact O-N 2.7Å; T441-T443 PolarHBondContact O-N 3.36Å; T441-T443 VanDerWaalsContact O-N 3.08Å
442	V	38.7	Very low	41.2	Very low	126 Å²	126	140 Å²	140	76%	0.764	77%	0.768	S	S	*	*			trans	-67.5	104	169.7	179.6	0	0	0	0	108	S440 V444	S440-V442 PolarHBondContact O-N 3.24Å; V442-V444 HydrophobicContact CG1-CG2 4.27Å; V442-V444 PolarHBondContact O-N 3.06Å
443	T	40.1	Very low	39.7	Very low	127 Å²	127	142 Å²	142	78%	0.779	77%	0.773	S	S	*	*			trans	-71.8	106.1	173.5	48.7	0	0	0	0	109.5	T441	T441-T443 PolarHBondContact O-N 3.36Å; T441-T443 VanDerWaalsContact O-N 3.08Å
444	V	36.9	Very low	38.6	Very low	113 Å²	113	140.3 Å²	140.3	69%	0.685	78%	0.777	S	S	*	*			trans	-94.4	116.8	167	-177.7	0	0	0	0	107.7	V442 T446	V442-V444 HydrophobicContact CG1-CG2 4.27Å; V442-V444 PolarHBondContact O-N 3.06Å; V444-T446 HydrophobicContact CG1-CG2 4.24Å
445	E	36.4	Very low	37.5	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	78%	0.784	S	S	*	*			trans	-74.8	123.2	170	-65	-177.4	138.7	0	0	109.4
446	T	34	Very low	36.5	Very low	124 Å²	124	147.8 Å²	147.8	76%	0.761	80%	0.797	S	S	*	*			trans	-121.2	106.1	168.8	53.6	0	0	0	0	109.2	V444	V444-T446 HydrophobicContact CG1-CG2 4.24Å
447	V	33.6	Very low	35.2	Very low	137 Å²	137	144.4 Å²	144.4	83%	0.83	80%	0.798	S	S	*	*			trans	-74.6	130.5	171.8	176.8	0	0	0	0	109
448	E	31.3	Very low	34.6	Very low	181 Å²	181	147.9 Å²	147.9	85%	0.846	81%	0.807	S	S	*	*			trans	-67.8	146.6	175	-61.2	-179.5	152.4	0	0	112
449	P	33.5	Very low	34.2	Very low	123 Å²	123	147.7 Å²	147.7	80%	0.799	81%	0.813	S	S	*	*			trans	-121.4	131.1	142.1	34.4	-26.6	0	0	0	111.3
450	S	29.5	Very low	33.4	Very low	106 Å²	106	144.8 Å²	144.8	74%	0.741	81%	0.81	S	S	*	*			trans	-66.9	142.3	168.5	56.4	0	0	0	0	111.9
451	Q	31.6	Very low	33	Very low	180 Å²	180	143.6 Å²	143.6	84%	0.841	81%	0.814	S	S	*	*				-171.9	162.6	107.6	-104.8	173.3	-6.3	0	0	113.1
452	D	30.3	Very low	32.6	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	81%	0.81	S	S	*	*			trans	-63.9	141	179.6	-48	-100.7	0	0	0	113.1
453	E	32.8	Very low	32.5	Very low	197 Å²	197	142.6 Å²	142.6	92%	0.921	81%	0.811	S	S	*	*				-159.5	134.1	120.5	-114.2	177.8	-172.5	0	0	110.9
454	A	30.5	Very low	32.1	Very low	96 Å²	96	142.4 Å²	142.4	79%	0.793	81%	0.811	S	S	*	*			trans	-99.2	105.1	-167.4	0	0	0	0	0	112.8
455	Q	30.3	Very low	31.7	Very low	189 Å²	189	142.5 Å²	142.5	88%	0.883	81%	0.812	S	S	*	*			trans	-161.7	76	166.5	-121.9	165.9	65.8	0	0	115.4
456	T	26	Very low	31.3	Very low	138 Å²	138	140.3 Å²	140.3	85%	0.847	81%	0.812	S	S	*	*	S	Bend	trans	-176	109.2	136	16.7	0	0	0	0	112.4	E458	T456-E458 PolarHBondContact O-N 2.72Å
457	T	26.3	Very low	30.9	Very low	134 Å²	134	141 Å²	141	82%	0.822	81%	0.81	S	S	*	*			trans	14.3	95.3	153.5	52.5	0	0	0	0	118.8
458	E	26.9	Very low	30.6	Very low	180 Å²	180	145.9 Å²	145.9	84%	0.841	81%	0.814	S	S	*	*			trans	-66.6	138.5	149.3	-76.8	-164.5	124.2	0	0	110.2	T456 V460	T456-E458 PolarHBondContact O-N 2.72Å; E458-V460 PolarHBondContact O-N 3.19Å
459	Q	38.7	Very low	30.4	Very low	201 Å²	201	146.4 Å²	146.4	94%	0.939	82%	0.816	S	S	*	*			trans	-86.4	80.9	172.9	-68.4	-172	-71.4	0	0	111.3
460	V	29.1	Very low	30.1	Very low	118 Å²	118	146.4 Å²	146.4	72%	0.715	81%	0.814	S	S	*	*			trans	-125.1	106.9	165.8	-175.3	0	0	0	0	109.3	E458 P462	E458-V460 PolarHBondContact O-N 3.19Å; V460-P462 WeakPolarHBondContact O-CD 3.26Å
461	G	30.6	Very low	30	Very low	81 Å²	81	146.5 Å²	146.5	84%	0.835	81%	0.811	S	S	*	*			trans	-111.6	102.9	-176.6	0	0	0	0	0	113.4
462	P	36.8	Very low	29.9	Very low	105 Å²	105	144.8 Å²	144.8	68%	0.682	81%	0.807	S	S	*	*			trans	-95.1	129.7	172.8	33.9	-30.6	0	0	0	112.7	V460	V460-P462 WeakPolarHBondContact O-CD 3.26Å
463	T	37.6	Very low	29.8	Very low	127 Å²	127	145.2 Å²	145.2	78%	0.779	81%	0.807	S	S	*	*			trans	40.2	124.6	155.4	53.7	0	0	0	0	120.2
464	P	31.7	Very low	29.6	Very low	122 Å²	122	141 Å²	141	79%	0.792	79%	0.794	S	S	*	*				-125	144.7	93.5	35.4	-30.3	0	0	0	111.7
465	V	27.7	Very low	29.6	Very low	115 Å²	115	142 Å²	142	70%	0.697	79%	0.79	S	S	*	*				60.4	102	67.2	-176.1	0	0	0	0	113.6
466	T	27.7	Very low	29.5	Very low	141 Å²	141	138.2 Å²	138.2	87%	0.865	79%	0.785	S	S	*	*			trans	-137	144.9	145.1	35.8	0	0	0	0	109.7
467	N	26.1	Very low	29.7	Very low	137 Å²	137	139.8 Å²	139.8	73%	0.733	79%	0.787	S	S	*	*			trans	-81.6	137.3	-176.5	-74.5	-19.8	0	0	0	110.4
468	W	28	Very low	29.8	Very low	240 Å²	240	140.2 Å²	140.2	91%	0.909	79%	0.79	S	S	*	*				46.4	105.8	92.9	-73.1	58.5	0	0	0	114.6
469	E	26.4	Very low	30	Very low	192 Å²	192	137.4 Å²	137.4	90%	0.897	79%	0.787	S	S	*	*			trans	-130.8	157.9	134.8	-79.3	-158.1	144	0	0	110
470	T	28.4	Very low	29.7	Very low	123 Å²	123	137 Å²	137	76%	0.755	79%	0.785	S	S	*	*			trans	-67.7	164.5	-176.4	37.1	0	0	0	0	114.1
471	T	25.6	Very low	29.6	Very low	109 Å²	109	136.1 Å²	136.1	67%	0.669	78%	0.784	S	S	*	*			cis	-161.6	157.1	26.6	-13	0	0	0	0	112.7
472	N	30.2	Very low	29.5	Very low	143 Å²	143	138.5 Å²	138.5	77%	0.765	78%	0.783	S	S	*	*			trans	61.4	108.9	142.6	-69.3	-3.1	0	0	0	123.6
473	M	28.8	Very low	29	Very low	162 Å²	162	144.5 Å²	144.5	80%	0.798	79%	0.792	S	S	*	*				103.3	119.2	112.8	-151.8	167.1	173.8	0	0	121.5
474	T	28.7	Very low	28.5	Very low	107 Å²	107	143.3 Å²	143.3	66%	0.656	79%	0.789	S	S	*	*			trans	75.1	129.4	148.8	43	0	0	0	0	124.6
475	T	29.1	Very low	28.4	Very low	117 Å²	117	144.3 Å²	144.3	72%	0.718	79%	0.793	S	S	*	*			trans	66.7	95	143.4	51.7	0	0	0	0	121.7
476	S	28.5	Very low	28.4	Very low	110 Å²	110	148.1 Å²	148.1	77%	0.769	80%	0.803	S	S	*	*				49.3	103.9	126.8	62	0	0	0	0	120.4
477	L	30.7	Very low	28.4	Very low	172 Å²	172	151.4 Å²	151.4	90%	0.901	81%	0.805	S	S	*	*			trans	-140.6	132.2	154.1	-83.8	173	0	0	0	110.3
478	T	28.1	Very low	28.3	Very low	142 Å²	142	151 Å²	151	87%	0.871	81%	0.809	S	S	*	*			trans	-156.5	146.7	161.5	24.7	0	0	0	0	108.4
479	P	31.3	Very low	28.2	Very low	122 Å²	122	149.1 Å²	149.1	79%	0.792	81%	0.807	S	S	*	*				-129.6	164.9	-112.8	39.6	-27.7	0	0	0	116.7
480	Q	33.4	Very low	28.3	Very low	192 Å²	192	145.7 Å²	145.7	90%	0.897	80%	0.799	S	S	*	*			trans	-87.3	156.3	154.9	-72	-177.1	-34.2	0	0	110.6
481	S	27.2	Very low	28.2	Very low	99 Å²	99	147.6 Å²	147.6	69%	0.692	80%	0.803	S	S	*	*			trans	-153.6	112.8	156.5	-172.8	0	0	0	0	113.1
482	T	27.7	Very low	28.3	Very low	131 Å²	131	148.3 Å²	148.3	80%	0.804	81%	0.81	S	S	*	*			trans	51.1	164.6	138.5	71.2	0	0	0	0	119.6
483	R	26.9	Very low	28.5	Very low	231 Å²	231	148.1 Å²	148.1	87%	0.872	81%	0.813	S	S	*	*			cis	-165.5	146.5	30.9	168.8	-173.1	173.6	173.3	-2.1	108.1
484	S	27.5	Very low	28.5	Very low	102 Å²	102	146.3 Å²	146.3	71%	0.713	81%	0.811	S	S	*	*			cis	-159.5	-179.7	-9.8	45.7	0	0	0	0	109.4
485	T	27.7	Very low	28.4	Very low	144 Å²	144	148.6 Å²	148.6	88%	0.883	82%	0.82	S	S	*	*			trans	-104.6	166	-177.6	44.5	0	0	0	0	114.5
486	E	28.9	Very low	28.7	Very low	195 Å²	195	147 Å²	147	91%	0.911	82%	0.818	S	S	*	*			trans	-126.3	178.7	170.2	-140.1	171	-153.5	0	0	111.9
487	K	27.2	Very low	28.8	Very low	209 Å²	209	148.7 Å²	148.7	91%	0.909	82%	0.819	S	S	*	*			trans	-100.2	156.3	-153.3	-70	179.4	177.5	175.7	0	117.1
488	T	24.2	Very low	28.9	Very low	130 Å²	130	148.5 Å²	148.5	80%	0.798	82%	0.818	S	S	*	*			trans	-90.9	156.6	176.4	-47.7	0	0	0	0	113.2
489	F	26.3	Very low	29.2	Very low	200 Å²	200	144.9 Å²	144.9	88%	0.877	81%	0.81	S	S	*	*			trans	-128.4	154.1	166.5	-138.2	-88.9	0	0	0	110.4
490	T	28	Very low	29.7	Very low	120 Å²	120	147.2 Å²	147.2	74%	0.736	81%	0.814	S	S	*	*			trans	-124.5	146.9	-167.5	48.2	0	0	0	0	114.5
491	I	25.7	Very low	30.6	Very low	162 Å²	162	144 Å²	144	83%	0.831	81%	0.81	S	S	*	*			trans	-137	146	171.8	-66.4	-175.8	0	0	0	108.1
492	P	28.3	Very low	31.9	Very low	125 Å²	125	141.7 Å²	141.7	81%	0.812	80%	0.802	S	S	*	*			trans	-99.1	-172	-156.3	39.7	-37.9	0	0	0	116.4
493	V	35.3	Very low	33.2	Very low	138 Å²	138	142.3 Å²	142.3	84%	0.836	80%	0.798	S	S	*	*			trans	-122.2	130.2	-170	176.3	0	0	0	0	113.2
494	T	28	Very low	34.5	Very low	124 Å²	124	136.1 Å²	136.1	76%	0.761	78%	0.783	S	S	*	*			trans	-157.8	156.6	152.6	43.1	0	0	0	0	106.6
495	D	26	Very low	35.9	Very low	156 Å²	156	138.3 Å²	138.3	83%	0.834	78%	0.782	S	S	*	*			cis	-148.5	-178.7	-5.2	-123.2	-44	0	0	0	109.8
496	A	35.3	Very low	37.2	Very low	82 Å²	82	135.7 Å²	135.7	68%	0.678	77%	0.765	S	S	*	*			trans	-85.8	168.5	-169.6	0	0	0	0	0	117.3
497	N	32.1	Very low	38.6	Very low	147 Å²	147	130.7 Å²	130.7	79%	0.786	74%	0.743	S	S	*	*			trans	71.3	104.9	166.2	-63.7	-18.3	0	0	0	119.7
498	N	31	Very low	40.3	Very low	167 Å²	167	126.9 Å²	126.9	89%	0.893	73%	0.726	S	S	*	*				-176	149.8	106.5	-96.8	-38.9	0	0	0	114.9
499	G	34.4	Very low	42.2	Very low	67 Å²	67	124.4 Å²	124.4	69%	0.691	71%	0.711	S	S	*	*			trans	39.6	114.7	152	0	0	0	0	0	121.5	P501	G499-P501 VanDerWaalsContact O-CD 3.29Å; G499-P501 WeakPolarHBondContact O-CD 3.43Å
500	I	42.8	Very low	44	Very low	170 Å²	170	118.1 Å²	118.1	87%	0.872	69%	0.689	S	S	*	*			trans	-72.3	124.1	169.3	-59.3	165.9	0	0	0	111.3
501	P	51.9	Low	46	Very low	125 Å²	125	118.8 Å²	118.8	81%	0.812	68%	0.682	S	S	*	*			trans	-115.3	100.6	169.1	32.4	-14.6	0	0	0	110.4	G499	G499-P501 VanDerWaalsContact O-CD 3.29Å; G499-P501 WeakPolarHBondContact O-CD 3.43Å
502	G	54	Low	48.5	Very low	51 Å²	51	116.2 Å²	116.2	53%	0.526	67%	0.669	S	S	.	*			trans	-158.4	21.6	-166.8	0	0	0	0	0	118.8
503	I	55.3	Low	50.8	Low	143 Å²	143	115.8 Å²	115.8	73%	0.733	66%	0.658	S	S	*	*	S	Bend	trans	-134.1	-50.9	179.9	-46.4	178.9	0	0	0	112.4	E505 V506 M507	I503-E505 PolarHBondContact O-N 3.24Å; I503-V506 PolarHBondContact O-N 2.86Å; I503-M507 PolarHBondContact O-N 2.82Å; I503-M507 VanDerWaalsContact O-N 3.13Å
504	D	53.7	Low	52.9	Low	102 Å²	102	114.1 Å²	114.1	55%	0.545	64%	0.644	S	S	.	*	H	α-helix	trans	-68.7	-38.1	-173.5	-165.8	57	0	0	0	113.1	V506 M507 K508	D504-V506 VanDerWaalsContact C-N 3.3Å; D504-V506 PolarHBondContact O-N 3.06Å; D504-M507 PolarHBondContact O-N 3.05Å; D504-M507 WeakPolarHBondContact OD1-CE 3.38Å; D504-K508 VanDerWaalsContact O-CB 3.29Å; D504-K508 WeakPolarHBondContact O-CB 3.35Å; D504-K508 PolarHBondContact O-N 3.3Å
505	E	57.7	Low	55.5	Low	148 Å²	148	110.1 Å²	110.1	69%	0.692	63%	0.627	S	S	*	*	H	α-helix	trans	-64.4	-33.2	175.9	-63.1	-145.4	126.2	0	0	113.2	I503 K508 T509	I503-E505 PolarHBondContact O-N 3.24Å; E505-K508 PolarHBondContact O-N 3.37Å; E505-T509 PolarHBondContact O-N 3.43Å; E505-T509 PolarHBondContact O-OG1 3.32Å
506	V	56.2	Low	58.2	Low	89 Å²	89	106 Å²	106	54%	0.539	61%	0.61	S	S	.	*	H	α-helix	trans	-67	-46	174.2	-175	0	0	0	0	109.6	I503 D504 K508 T509 T510	I503-V506 PolarHBondContact O-N 2.86Å; D504-V506 VanDerWaalsContact C-N 3.3Å; D504-V506 PolarHBondContact O-N 3.06Å; V506-K508 VanDerWaalsContact C-N 3.28Å; V506-K508 PolarHBondContact O-N 3.38Å; V506-T509 PolarHBondContact O-N 3.16Å; V506-T509 PolarHBondContact O-OG1 2.76Å; V506-T509 VanDerWaalsContact O-OG1 3.05Å; V506-T510 WeakPolarHBondContact O-CB 3.45Å; V506-T510 PolarHBondContact O-N 3.48Å; V506-T510 PolarHBondContact O-OG1 3.49Å
507	M	57.4	Low	60.5	Low	90 Å²	90	109 Å²	109	44%	0.443	61%	0.608	S	S	.	*	H	α-helix	trans	-63	-34.1	175	-178.3	171.6	49.7	0	0	112.5	I503 D504 K511	I503-M507 PolarHBondContact O-N 2.82Å; I503-M507 VanDerWaalsContact O-N 3.13Å; D504-M507 PolarHBondContact O-N 3.05Å; D504-M507 WeakPolarHBondContact OD1-CE 3.38Å; M507-K511 HydrophobicContact CG-CD 4.4Å; M507-K511 VanDerWaalsContact O-CG 3.31Å; M507-K511 WeakPolarHBondContact O-CG 3.29Å; M507-K511 PolarHBondContact O-N 3.41Å; M507-K511 VanDerWaalsContact O-N 3.17Å
508	K	62.3	Low	63.2	Low	129 Å²	129	105.8 Å²	105.8	56%	0.561	59%	0.593	S	S	*	*	H	α-helix	trans	-72	-45.1	179.2	-163.6	172.5	-176	178	0	112.1	D504 E505 V506 K511 I512	D504-K508 VanDerWaalsContact O-CB 3.29Å; D504-K508 WeakPolarHBondContact O-CB 3.35Å; D504-K508 PolarHBondContact O-N 3.3Å; E505-K508 PolarHBondContact O-N 3.37Å; V506-K508 VanDerWaalsContact C-N 3.28Å; V506-K508 PolarHBondContact O-N 3.38Å; K508-K511 PolarHBondContact O-N 2.89Å; K508-I512 WeakPolarHBondContact O-CG1 3.37Å; K508-I512 PolarHBondContact O-N 3.44Å
509	T	64.4	Low	65.7	Low	77 Å²	77	100.4 Å²	100.4	47%	0.472	57%	0.572	S	S	.	*	H	α-helix	trans	-66.5	-41.7	174.4	46	0	0	0	0	112.2	E505 V506 K511 I512 I513	E505-T509 PolarHBondContact O-N 3.43Å; E505-T509 PolarHBondContact O-OG1 3.32Å; V506-T509 PolarHBondContact O-N 3.16Å; V506-T509 PolarHBondContact O-OG1 2.76Å; V506-T509 VanDerWaalsContact O-OG1 3.05Å; T509-K511 VanDerWaalsContact C-N 3.33Å; T509-K511 PolarHBondContact O-N 3.01Å; T509-I512 PolarHBondContact O-N 3.47Å; T509-I512 VanDerWaalsContact O-N 3.16Å; T509-I513 WeakPolarHBondContact O-CG1 3.38Å; T509-I513 PolarHBondContact O-N 3.31Å
510	T	63.9	Low	68.3	Low	68 Å²	68	102.8 Å²	102.8	42%	0.417	57%	0.568	S	S	.	*	H	α-helix	trans	-58.9	-41.7	174.4	-59.3	0	0	0	0	112.3	V506 I512 I513 I514	V506-T510 WeakPolarHBondContact O-CB 3.45Å; V506-T510 PolarHBondContact O-N 3.48Å; V506-T510 PolarHBondContact O-OG1 3.49Å; T510-I512 VanDerWaalsContact C-N 3.34Å; T510-I512 PolarHBondContact O-N 2.9Å; T510-I513 PolarHBondContact O-N 3.45Å; T510-I514 HydrophobicContact CG2-CD1 3.91Å; T510-I514 HydrophobicContact CG2-CG1 4.49Å; T510-I514 WeakPolarHBondContact O-CG1 3.38Å; T510-I514 PolarHBondContact O-N 2.96Å
511	K	70.1	Confident	70.3	Confident	135 Å²	135	98 Å²	98	59%	0.587	55%	0.546	S	S	*	.	H	α-helix	trans	-61.5	-38.7	175.6	-78	169.3	-179.6	169.6	0	112.8	M507 K508 T509 G515	M507-K511 HydrophobicContact CG-CD 4.4Å; M507-K511 VanDerWaalsContact O-CG 3.31Å; M507-K511 WeakPolarHBondContact O-CG 3.29Å; M507-K511 PolarHBondContact O-N 3.41Å; M507-K511 VanDerWaalsContact O-N 3.17Å; K508-K511 PolarHBondContact O-N 2.89Å; T509-K511 VanDerWaalsContact C-N 3.33Å; T509-K511 PolarHBondContact O-N 3.01Å; K511-G515 PolarHBondContact O-N 2.94Å
512	I	78.4	Confident	72	Confident	107 Å²	107	97.1 Å²	97.1	55%	0.549	54%	0.535	S	S	.	.	H	α-helix	trans	-65.1	-46.6	176.6	-66.7	164.7	0	0	0	110.7	K508 T509 T510 I514 G515 C516	K508-I512 WeakPolarHBondContact O-CG1 3.37Å; K508-I512 PolarHBondContact O-N 3.44Å; T509-I512 PolarHBondContact O-N 3.47Å; T509-I512 VanDerWaalsContact O-N 3.16Å; T510-I512 VanDerWaalsContact C-N 3.34Å; T510-I512 PolarHBondContact O-N 2.9Å; I512-I514 PolarHBondContact O-N 3.37Å; I512-G515 PolarHBondContact O-N 3.49Å; I512-G515 VanDerWaalsContact O-N 3.17Å; I512-C516 PolarHBondContact O-N 3.27Å; I512-C516 PolarHBondContact O-SG 2.98Å
513	I	76.8	Confident	73.7	Confident	117 Å²	117	100.6 Å²	100.6	60%	0.6	54%	0.539	S	S	*	.	H	α-helix	trans	-60.9	-44.5	-180	-66.5	164.3	0	0	0	111.2	T509 T510 C516 F517	T509-I513 WeakPolarHBondContact O-CG1 3.38Å; T509-I513 PolarHBondContact O-N 3.31Å; T510-I513 PolarHBondContact O-N 3.45Å; I513-C516 PolarHBondContact O-N 3.33Å; I513-F517 PolarHBondContact O-N 3.32Å
514	I	78.9	Confident	75.1	Confident	102 Å²	102	96.1 Å²	96.1	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-43.5	175.7	-65.5	170.8	0	0	0	110.6	T510 I512 C516 F517 V518	T510-I514 HydrophobicContact CG2-CD1 3.91Å; T510-I514 HydrophobicContact CG2-CG1 4.49Å; T510-I514 WeakPolarHBondContact O-CG1 3.38Å; T510-I514 PolarHBondContact O-N 2.96Å; I512-I514 PolarHBondContact O-N 3.37Å; I514-C516 PolarHBondContact O-N 3.36Å; I514-F517 PolarHBondContact O-N 3.43Å; I514-V518 HydrophobicContact CG2-CG2 4.47Å; I514-V518 WeakPolarHBondContact O-CG2 3.34Å; I514-V518 PolarHBondContact O-N 3.49Å
515	G	82.1	Confident	76.8	Confident	41 Å²	41	93.7 Å²	93.7	42%	0.423	52%	0.517	S	S	.	.	H	α-helix	trans	-58.2	-45.8	176.1	0	0	0	0	0	113	K511 I512 F517 V518 A519	K511-G515 PolarHBondContact O-N 2.94Å; I512-G515 PolarHBondContact O-N 3.49Å; I512-G515 VanDerWaalsContact O-N 3.17Å; G515-F517 PolarHBondContact O-N 2.91Å; G515-V518 PolarHBondContact O-N 3.43Å; G515-A519 WeakPolarHBondContact O-CB 3.28Å; G515-A519 PolarHBondContact O-N 2.97Å
516	C	83.9	Confident	78.4	Confident	69 Å²	69	89.9 Å²	89.9	47%	0.466	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-41.9	174.8	-70	0	0	0	0	112.4	I512 I513 I514 A519 I520	I512-C516 PolarHBondContact O-N 3.27Å; I512-C516 PolarHBondContact O-SG 2.98Å; I513-C516 PolarHBondContact O-N 3.33Å; I514-C516 PolarHBondContact O-N 3.36Å; C516-A519 PolarHBondContact O-N 3.48Å; C516-I520 WeakPolarHBondContact O-CB 3.4Å; C516-I520 VanDerWaalsContact O-CG1 3.26Å; C516-I520 WeakPolarHBondContact O-CG1 3.47Å; C516-I520 PolarHBondContact O-N 2.78Å
517	F	84.3	Confident	79.9	Confident	144 Å²	144	91.3 Å²	91.3	63%	0.632	51%	0.506	S	S	*	.	H	α-helix	trans	-65.6	-40.7	179.3	-163.5	-93.1	0	0	0	112.4	I513 I514 G515 T521	I513-F517 PolarHBondContact O-N 3.32Å; I514-F517 PolarHBondContact O-N 3.43Å; G515-F517 PolarHBondContact O-N 2.91Å; F517-T521 HydrophobicContact CD1-CG2 4.15Å; F517-T521 HydrophobicContact CE1-CG2 3.85Å; F517-T521 HydrophobicContact CZ-CG2 4.3Å; F517-T521 WeakPolarHBondContact O-CB 3.47Å; F517-T521 WeakPolarHBondContact O-CG2 3.42Å; F517-T521 PolarHBondContact O-N 3.02Å; F517-T521 PolarHBondContact O-OG1 2.92Å
518	V	87.4	Confident	81.4	Confident	80 Å²	80	92.8 Å²	92.8	49%	0.485	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-42.1	173.5	174.3	0	0	0	0	111.1	I514 G515 T521 L522	I514-V518 HydrophobicContact CG2-CG2 4.47Å; I514-V518 WeakPolarHBondContact O-CG2 3.34Å; I514-V518 PolarHBondContact O-N 3.49Å; G515-V518 PolarHBondContact O-N 3.43Å; V518-T521 WeakPolarHBondContact CA-OG1 3.42Å; V518-T521 PolarHBondContact O-OG1 3.31Å; V518-T521 VanDerWaalsContact O-OG1 3.12Å; V518-L522 VanDerWaalsContact O-CB 3.27Å; V518-L522 WeakPolarHBondContact O-CB 3.35Å; V518-L522 PolarHBondContact O-N 2.96Å
519	A	84.6	Confident	82.7	Confident	54 Å²	54	90.9 Å²	90.9	45%	0.446	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-45.3	177.3	0	0	0	0	0	112.5	G515 C516 L522 M523	G515-A519 WeakPolarHBondContact O-CB 3.28Å; G515-A519 PolarHBondContact O-N 2.97Å; C516-A519 PolarHBondContact O-N 3.48Å; A519-L522 PolarHBondContact O-N 3.12Å; A519-M523 WeakPolarHBondContact O-CB 3.42Å; A519-M523 VanDerWaalsContact O-CG 3.28Å; A519-M523 WeakPolarHBondContact O-CG 3.47Å; A519-M523 PolarHBondContact O-N 2.99Å
520	I	89.2	Confident	83.7	Confident	117 Å²	117	91 Å²	91	60%	0.6	51%	0.511	S	S	*	.	H	α-helix	trans	-64.3	-45.1	178.9	-69.3	164.8	0	0	0	111.1	C516 M523 A524	C516-I520 WeakPolarHBondContact O-CB 3.4Å; C516-I520 VanDerWaalsContact O-CG1 3.26Å; C516-I520 WeakPolarHBondContact O-CG1 3.47Å; C516-I520 PolarHBondContact O-N 2.78Å; I520-M523 PolarHBondContact O-N 3.45Å; I520-A524 WeakPolarHBondContact O-CB 3.41Å; I520-A524 PolarHBondContact O-N 3.02Å
521	T	84	Confident	84.7	Confident	69 Å²	69	94 Å²	94	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-67.2	-37.3	179.6	48.2	0	0	0	0	112.5	F517 V518 A524 A525	F517-T521 HydrophobicContact CD1-CG2 4.15Å; F517-T521 HydrophobicContact CE1-CG2 3.85Å; F517-T521 HydrophobicContact CZ-CG2 4.3Å; F517-T521 WeakPolarHBondContact O-CB 3.47Å; F517-T521 WeakPolarHBondContact O-CG2 3.42Å; F517-T521 PolarHBondContact O-N 3.02Å; F517-T521 PolarHBondContact O-OG1 2.92Å; V518-T521 WeakPolarHBondContact CA-OG1 3.42Å; V518-T521 PolarHBondContact O-OG1 3.31Å; V518-T521 VanDerWaalsContact O-OG1 3.12Å; T521-A524 PolarHBondContact O-N 3.5Å; T521-A525 WeakPolarHBondContact O-CB 3.31Å; T521-A525 PolarHBondContact O-N 3.17Å
522	L	88.5	Confident	85.6	Confident	108 Å²	108	95 Å²	95	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-68.3	-42.6	175.6	-160.4	157.7	0	0	0	111.4	V518 A519 A524 A525 V526	V518-L522 VanDerWaalsContact O-CB 3.27Å; V518-L522 WeakPolarHBondContact O-CB 3.35Å; V518-L522 PolarHBondContact O-N 2.96Å; A519-L522 PolarHBondContact O-N 3.12Å; L522-A524 PolarHBondContact O-N 3.02Å; L522-A525 PolarHBondContact O-N 3.47Å; L522-V526 HydrophobicContact CD2-CG2 4.12Å; L522-V526 WeakPolarHBondContact O-CG2 3.47Å; L522-V526 PolarHBondContact O-N 3.48Å
523	M	88.4	Confident	85.5	Confident	124 Å²	124	97.1 Å²	97.1	61%	0.611	53%	0.525	S	S	*	.	H	α-helix	trans	-62	-41.2	173	-73.3	-66.8	-73.8	0	0	112.3	A519 I520 A525 V526 M527	A519-M523 WeakPolarHBondContact O-CB 3.42Å; A519-M523 VanDerWaalsContact O-CG 3.28Å; A519-M523 WeakPolarHBondContact O-CG 3.47Å; A519-M523 PolarHBondContact O-N 2.99Å; I520-M523 PolarHBondContact O-N 3.45Å; M523-A525 PolarHBondContact O-N 3.38Å; M523-V526 PolarHBondContact O-N 3.22Å; M523-M527 WeakPolarHBondContact O-CG 3.44Å; M523-M527 PolarHBondContact O-N 2.93Å
524	A	86	Confident	85.4	Confident	48 Å²	48	97.3 Å²	97.3	40%	0.397	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-41.1	174.9	0	0	0	0	0	112.1	I520 T521 L522 M527 L528	I520-A524 WeakPolarHBondContact O-CB 3.41Å; I520-A524 PolarHBondContact O-N 3.02Å; T521-A524 PolarHBondContact O-N 3.5Å; L522-A524 PolarHBondContact O-N 3.02Å; A524-M527 PolarHBondContact O-N 3.06Å; A524-L528 WeakPolarHBondContact O-CG 3.4Å; A524-L528 PolarHBondContact O-N 3.34Å
525	A	89.2	Confident	85.3	Confident	51 Å²	51	100.9 Å²	100.9	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-42.9	174.7	0	0	0	0	0	112.2	T521 L522 M523 L528 V529	T521-A525 WeakPolarHBondContact O-CB 3.31Å; T521-A525 PolarHBondContact O-N 3.17Å; L522-A525 PolarHBondContact O-N 3.47Å; M523-A525 PolarHBondContact O-N 3.38Å; A525-L528 PolarHBondContact O-N 3.44Å; A525-V529 WeakPolarHBondContact O-CG2 3.34Å; A525-V529 PolarHBondContact O-N 3.17Å
526	V	90.5	Very high	85	Confident	69 Å²	69	105.3 Å²	105.3	42%	0.418	54%	0.539	S	S	.	.	H	α-helix	trans	-60.7	-45.3	174.4	169.8	0	0	0	0	111.2	L522 M523 L528 V529 I530	L522-V526 HydrophobicContact CD2-CG2 4.12Å; L522-V526 WeakPolarHBondContact O-CG2 3.47Å; L522-V526 PolarHBondContact O-N 3.48Å; M523-V526 PolarHBondContact O-N 3.22Å; V526-L528 PolarHBondContact O-N 3.26Å; V526-V529 PolarHBondContact O-N 3.43Å; V526-I530 HydrophobicContact CG1-CD1 3.86Å; V526-I530 WeakPolarHBondContact O-CG1 3.29Å; V526-I530 PolarHBondContact O-N 2.95Å
527	M	88.1	Confident	84.3	Confident	118 Å²	118	108.2 Å²	108.2	58%	0.581	55%	0.546	S	S	*	.	H	α-helix	trans	-63	-39	177.4	-71	-64.2	-74	0	0	112.5	M523 A524 I530 F531	M523-M527 WeakPolarHBondContact O-CG 3.44Å; M523-M527 PolarHBondContact O-N 2.93Å; A524-M527 PolarHBondContact O-N 3.06Å; M527-I530 PolarHBondContact O-N 3.44Å; M527-I530 HydrophobicContact SD-CD1 4.36Å; M527-F531 WeakPolarHBondContact O-CB 3.49Å; M527-F531 PolarHBondContact O-N 2.95Å
528	L	89.1	Confident	83.2	Confident	121 Å²	121	107 Å²	107	63%	0.634	54%	0.542	S	S	*	.	H	α-helix	trans	-64.8	-38.8	173.7	-74.1	169	0	0	0	112.4	A524 A525 V526 F531 Y532	A524-L528 WeakPolarHBondContact O-CG 3.4Å; A524-L528 PolarHBondContact O-N 3.34Å; A525-L528 PolarHBondContact O-N 3.44Å; V526-L528 PolarHBondContact O-N 3.26Å; L528-F531 PolarHBondContact O-N 3.46Å; L528-Y532 WeakPolarHBondContact O-CB 3.5Å; L528-Y532 PolarHBondContact O-N 2.89Å
529	V	88.3	Confident	81.9	Confident	89 Å²	89	109 Å²	109	54%	0.539	55%	0.546	S	S	.	.	H	α-helix	trans	-67.1	-38.9	175.2	170.6	0	0	0	0	111.7	A525 V526 K533	A525-V529 WeakPolarHBondContact O-CG2 3.34Å; A525-V529 PolarHBondContact O-N 3.17Å; V526-V529 PolarHBondContact O-N 3.43Å; V529-K533 PolarHBondContact O-N 3.36Å
530	I	86.8	Confident	80.5	Confident	81 Å²	81	116.4 Å²	116.4	42%	0.415	56%	0.562	S	S	.	*	H	α-helix	trans	-63	-49.5	173.2	-68.7	166.2	0	0	0	110.2	V526 M527 Y532 K533 M534	V526-I530 HydrophobicContact CG1-CD1 3.86Å; V526-I530 WeakPolarHBondContact O-CG1 3.29Å; V526-I530 PolarHBondContact O-N 2.95Å; M527-I530 PolarHBondContact O-N 3.44Å; M527-I530 HydrophobicContact SD-CD1 4.36Å; I530-Y532 VanDerWaalsContact C-N 3.32Å; I530-Y532 PolarHBondContact O-N 2.85Å; I530-K533 WeakPolarHBondContact O-CB 3.32Å; I530-K533 PolarHBondContact O-N 3.13Å; I530-K533 VanDerWaalsContact O-N 3.14Å; I530-M534 HydrophobicContact CG2-CG 4.48Å; I530-M534 HydrophobicContact CG2-SD 4.11Å; I530-M534 WeakPolarHBondContact O-CG 3.48Å; I530-M534 PolarHBondContact O-N 3.2Å
531	F	84.6	Confident	78.9	Confident	130 Å²	130	117.4 Å²	117.4	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-60.4	-40.3	178.8	-167.3	-99.6	0	0	0	112.1	M527 L528 M534 R535	M527-F531 WeakPolarHBondContact O-CB 3.49Å; M527-F531 PolarHBondContact O-N 2.95Å; L528-F531 PolarHBondContact O-N 3.46Å; F531-M534 PolarHBondContact O-N 3.34Å; F531-R535 WeakPolarHBondContact O-CB 3.39Å; F531-R535 PolarHBondContact O-N 3.49Å
532	Y	88.2	Confident	77.2	Confident	156 Å²	156	119.5 Å²	119.5	61%	0.612	57%	0.573	S	S	*	*	H	α-helix	trans	-64.6	-41.7	174.2	-177.1	-112.5	0	0	0	112.6	L528 I530 R535 K536	L528-Y532 WeakPolarHBondContact O-CB 3.5Å; L528-Y532 PolarHBondContact O-N 2.89Å; I530-Y532 VanDerWaalsContact C-N 3.32Å; I530-Y532 PolarHBondContact O-N 2.85Å; Y532-R535 PolarHBondContact O-N 3.49Å; Y532-K536 WeakPolarHBondContact O-CB 3.35Å; Y532-K536 PolarHBondContact O-N 3.31Å
533	K	77.1	Confident	75.2	Confident	151 Å²	151	120.9 Å²	120.9	66%	0.657	58%	0.576	S	S	*	*	H	α-helix	trans	-60.7	-48.3	172.2	-90.4	-172.9	172.8	-178.4	0	111.9	V529 I530 R535 K536 Q537	V529-K533 PolarHBondContact O-N 3.36Å; I530-K533 WeakPolarHBondContact O-CB 3.32Å; I530-K533 PolarHBondContact O-N 3.13Å; I530-K533 VanDerWaalsContact O-N 3.14Å; K533-R535 PolarHBondContact O-N 3.37Å; K533-K536 PolarHBondContact O-N 3.07Å; K533-Q537 WeakPolarHBondContact O-CB 3.5Å; K533-Q537 PolarHBondContact O-N 3.41Å
534	M	74.9	Confident	73	Confident	122 Å²	122	123.6 Å²	123.6	60%	0.601	59%	0.587	S	S	*	*	H	α-helix	trans	-60	-46	178.1	-70.4	179.6	71.3	0	0	111.6	I530 F531 K536 Q537 H538	I530-M534 HydrophobicContact CG2-CG 4.48Å; I530-M534 HydrophobicContact CG2-SD 4.11Å; I530-M534 WeakPolarHBondContact O-CG 3.48Å; I530-M534 PolarHBondContact O-N 3.2Å; F531-M534 PolarHBondContact O-N 3.34Å; M534-K536 VanDerWaalsContact C-N 3.34Å; M534-K536 PolarHBondContact O-N 3.49Å; M534-Q537 WeakPolarHBondContact O-CB 3.42Å; M534-Q537 PolarHBondContact O-N 3.27Å; M534-Q537 VanDerWaalsContact O-N 3.16Å; M534-H538 PolarHBondContact O-N 3.06Å
535	R	76.7	Confident	70.6	Confident	177 Å²	177	125.2 Å²	125.2	67%	0.668	60%	0.6	S	S	*	*	H	α-helix	trans	-63.3	-38.5	177.6	-165.6	171.3	-174.5	163.4	2.7	112.1	F531 Y532 K533 H539	F531-R535 WeakPolarHBondContact O-CB 3.39Å; F531-R535 PolarHBondContact O-N 3.49Å; Y532-R535 PolarHBondContact O-N 3.49Å; K533-R535 PolarHBondContact O-N 3.37Å; R535-H539 WeakPolarHBondContact O-CB 3.19Å; R535-H539 PolarHBondContact O-N 3.21Å
536	K	75.3	Confident	68.2	Low	134 Å²	134	128.7 Å²	128.7	58%	0.583	62%	0.619	S	S	*	*	H	α-helix	trans	-68.2	-32	174.3	-170.8	170.6	-176.7	173.4	0	112.8	Y532 K533 M534 R540	Y532-K536 WeakPolarHBondContact O-CB 3.35Å; Y532-K536 PolarHBondContact O-N 3.31Å; K533-K536 PolarHBondContact O-N 3.07Å; M534-K536 VanDerWaalsContact C-N 3.34Å; M534-K536 PolarHBondContact O-N 3.49Å; K536-R540 PolarHBondContact O-N 2.95Å
537	Q	69.4	Low	65.4	Low	130 Å²	130	132 Å²	132	61%	0.607	64%	0.639	S	S	*	*	H	α-helix	trans	-70.9	-46.1	174.7	-175.8	168.9	-17.2	0	0	111.6	K533 M534 H539 R540 Q541	K533-Q537 WeakPolarHBondContact O-CB 3.5Å; K533-Q537 PolarHBondContact O-N 3.41Å; M534-Q537 WeakPolarHBondContact O-CB 3.42Å; M534-Q537 PolarHBondContact O-N 3.27Å; M534-Q537 VanDerWaalsContact O-N 3.16Å; Q537-H539 VanDerWaalsContact C-N 3.3Å; Q537-H539 PolarHBondContact O-N 2.94Å; Q537-R540 WeakPolarHBondContact O-CB 3.27Å; Q537-R540 PolarHBondContact O-N 3.43Å; Q537-Q541 PolarHBondContact O-N 3.26Å
538	H	61.7	Low	62.8	Low	118 Å²	118	137.7 Å²	137.7	55%	0.546	65%	0.654	S	S	.	*	H	α-helix	trans	-59.4	-40.2	173.8	-169.1	-40.1	0	0	0	111.9	M534 R540 Q541 N542	M534-H538 PolarHBondContact O-N 3.06Å; H538-R540 PolarHBondContact O-N 3.02Å; H538-Q541 PolarHBondContact O-N 3.39Å; H538-N542 PolarHBondContact O-N 3.16Å; H538-N542 PolarHBondContact O-OD1 2.92Å
539	H	59.1	Low	60.1	Low	122 Å²	122	138 Å²	138	57%	0.565	66%	0.661	S	S	*	*	H	α-helix	trans	-67.7	-23.7	177.3	-148.4	-36.7	0	0	0	113	R535 Q537 H543	R535-H539 WeakPolarHBondContact O-CB 3.19Å; R535-H539 PolarHBondContact O-N 3.21Å; Q537-H539 VanDerWaalsContact C-N 3.3Å; Q537-H539 PolarHBondContact O-N 2.94Å; H539-H543 AromaticContact ND1-NE2 3.87Å; H539-H543 PolarHBondContact O-CD2 2.89Å; H539-H543 VanDerWaalsContact O-CD2 3.31Å
540	R	56.2	Low	57.3	Low	210 Å²	210	139.8 Å²	139.8	79%	0.792	67%	0.672	S	S	*	*	H	α-helix	trans	-77.4	-34	175	-117.4	-178.7	173.6	-170.6	-4.7	112.9	K536 Q537 H538 N542 H543	K536-R540 PolarHBondContact O-N 2.95Å; Q537-R540 WeakPolarHBondContact O-CB 3.27Å; Q537-R540 PolarHBondContact O-N 3.43Å; H538-R540 PolarHBondContact O-N 3.02Å; R540-N542 VanDerWaalsContact C-N 3.35Å; R540-H543 PolarHBondContact O-N 2.89Å
541	Q	54.9	Low	54.6	Low	138 Å²	138	144.5 Å²	144.5	65%	0.645	69%	0.692	S	S	*	*	H	α-helix	trans	-68.1	-34.3	176.8	-72.7	177.9	-54.8	0	0	112.1	Q537 H538 H543 H544	Q537-Q541 PolarHBondContact O-N 3.26Å; H538-Q541 PolarHBondContact O-N 3.39Å; Q541-H543 PolarHBondContact O-N 3.38Å; Q541-H543 VanDerWaalsContact O-N 3.07Å; Q541-H544 PolarHBondContact O-N 3.14Å
542	N	47.9	Very low	52.1	Low	112 Å²	112	145.7 Å²	145.7	60%	0.599	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-1.9	179	-73.9	23.7	0	0	0	115.3	H538 R540	H538-N542 PolarHBondContact O-N 3.16Å; H538-N542 PolarHBondContact O-OD1 2.92Å; R540-N542 VanDerWaalsContact C-N 3.35Å
543	H	46.8	Very low	49.4	Very low	137 Å²	137	145.2 Å²	145.2	63%	0.634	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	3.4	177.7	-78.5	-63.6	0	0	0	114.8	H539 R540 Q541	H539-H543 AromaticContact ND1-NE2 3.87Å; H539-H543 PolarHBondContact O-CD2 2.89Å; H539-H543 VanDerWaalsContact O-CD2 3.31Å; R540-H543 PolarHBondContact O-N 2.89Å; Q541-H543 PolarHBondContact O-N 3.38Å; Q541-H543 VanDerWaalsContact O-N 3.07Å
544	H	43.3	Very low	47	Very low	181 Å²	181	143.8 Å²	143.8	84%	0.838	71%	0.709	S	S	*	*			trans	-125.2	58	174.1	-74.1	-6.1	0	0	0	111.8	Q541	Q541-H544 PolarHBondContact O-N 3.14Å
545	A	35.2	Very low	45	Very low	82 Å²	82	144.2 Å²	144.2	68%	0.678	72%	0.718	S	S	*	*			trans	-98.6	128.6	157.3	0	0	0	0	0	108.4	T547	A545-T547 PolarHBondContact O-N 2.97Å
546	P	37.9	Very low	42.9	Very low	125 Å²	125	142 Å²	142	81%	0.812	72%	0.72	S	S	*	*			trans	-71.6	130.5	-179.8	28.7	-33.6	0	0	0	110.8	R548	P546-R548 PolarHBondContact O-N 2.93Å
547	T	32.1	Very low	40.9	Very low	137 Å²	137	143.2 Å²	143.2	84%	0.84	73%	0.732	S	S	*	*			trans	-69.8	96.7	176.4	44.8	0	0	0	0	110.9	A545 T549	A545-T547 PolarHBondContact O-N 2.97Å; T547-T549 PolarHBondContact O-N 3.2Å
548	R	33.4	Very low	39	Very low	238 Å²	238	146.3 Å²	146.3	90%	0.898	75%	0.747	S	S	*	*			trans	-73.5	113.7	156.4	-93.5	-176.6	165.7	168.6	-4.5	108.4	P546	P546-R548 PolarHBondContact O-N 2.93Å
549	T	31.6	Very low	37.5	Very low	129 Å²	129	148 Å²	148	79%	0.791	76%	0.759	S	S	*	*			trans	-68	132.1	167.4	40.9	0	0	0	0	109.6	T547	T547-T549 PolarHBondContact O-N 3.2Å
550	V	31.2	Very low	36.1	Very low	126 Å²	126	149.2 Å²	149.2	76%	0.764	78%	0.775	S	S	*	*			trans	-128.9	105.3	166.4	178.1	0	0	0	0	105.3
551	E	28.4	Very low	34.8	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	77%	0.769	S	S	*	*			trans	-76.6	133.4	174.1	-69.2	-178.4	130.6	0	0	109.2
552	I	33.1	Very low	33.5	Very low	155 Å²	155	143.7 Å²	143.7	80%	0.795	78%	0.782	S	S	*	*			trans	-95.7	109.2	172.4	-64.7	167.1	0	0	0	105.7	N554	I552-N554 PolarHBondContact O-N 3Å
553	I	30.4	Very low	32.5	Very low	147 Å²	147	144.7 Å²	144.7	75%	0.754	79%	0.792	S	S	*	*			trans	-77.9	118.3	175.2	-64.4	175.6	0	0	0	107.9
554	N	28.2	Very low	32.5	Very low	121 Å²	121	143.2 Å²	143.2	65%	0.647	79%	0.794	S	S	*	*			trans	-66.1	140.1	164.7	-110.1	44.6	0	0	0	109.2	I552 D556	I552-N554 PolarHBondContact O-N 3Å; N554-D556 PolarHBondContact ND2-OD2 2.97Å
555	V	31.8	Very low	32	Very low	130 Å²	130	142.3 Å²	142.3	79%	0.788	79%	0.794	S	S	*	*			trans	-109.4	109.5	164.2	-179.9	0	0	0	0	106.4
556	D	32.8	Very low	31.7	Very low	131 Å²	131	146 Å²	146	70%	0.701	80%	0.797	S	S	*	*			trans	-122.9	130.1	171.9	-70.7	-71.2	0	0	0	107.2	N554	N554-D556 PolarHBondContact ND2-OD2 2.97Å
557	D	32.6	Very low	31.3	Very low	159 Å²	159	146 Å²	146	85%	0.85	80%	0.8	S	S	*	*			trans	-79.8	130.3	-178.2	-72.5	-61.7	0	0	0	111.7
558	E	29.8	Very low	31.2	Very low	195 Å²	195	146.2 Å²	146.2	91%	0.911	79%	0.791	S	S	*	*			trans	-154.4	147.7	148.9	-128.9	169.3	-160.9	0	0	112.4
559	L	31.6	Very low	31.1	Very low	154 Å²	154	142 Å²	142	81%	0.806	79%	0.786	S	S	*	*			trans	-94.5	141.4	-178.5	-71.7	76.5	0	0	0	111
560	T	29.3	Very low	31.4	Very low	147 Å²	147	141.1 Å²	141.1	90%	0.902	78%	0.783	S	S	*	*				152.1	156.5	123.7	45.3	0	0	0	0	112.8
561	G	28.6	Very low	31.3	Very low	65 Å²	65	143.8 Å²	143.8	67%	0.67	79%	0.789	S	S	*	*			trans	99.7	95.6	149.5	0	0	0	0	0	118.3
562	D	26.8	Very low	31.6	Very low	168 Å²	168	141.3 Å²	141.3	90%	0.898	79%	0.788	S	S	*	*			trans	56.4	132.8	136.8	-56.5	-13.6	0	0	0	123.3
563	T	27.7	Very low	31.4	Very low	132 Å²	132	138.1 Å²	138.1	81%	0.81	79%	0.785	S	S	*	*			trans	-89.9	-174.8	160.9	60.3	0	0	0	0	109.1
564	P	46.9	Very low	31.4	Very low	107 Å²	107	138.3 Å²	138.3	70%	0.695	79%	0.786	S	S	*	*			cis	-140.1	-175	5.4	32.7	-8.1	0	0	0	115.9
565	I	31.6	Very low	31.4	Very low	162 Å²	162	139.8 Å²	139.8	83%	0.831	79%	0.789	S	S	*	*				156.8	147.9	128.1	-79.9	164.9	0	0	0	111.4
566	E	29.3	Very low	31.3	Very low	159 Å²	159	141 Å²	141	74%	0.743	79%	0.786	S	S	*	*			trans	-91.7	161.3	-165.7	-57.5	149.9	119.1	0	0	115.1
567	S	29.5	Very low	31	Very low	124 Å²	124	141.6 Å²	141.6	87%	0.867	78%	0.784	S	S	*	*			trans	-160.5	162.4	135	44.1	0	0	0	0	111
568	H	29.8	Very low	30.9	Very low	142 Å²	142	141.6 Å²	141.6	66%	0.657	78%	0.779	S	S	*	*			trans	-119.3	139.7	-151.7	-79.4	-93.2	0	0	0	116.7
569	L	31.9	Very low	30.8	Very low	149 Å²	149	139.6 Å²	139.6	78%	0.78	77%	0.774	S	S	*	*			trans	63.9	177.7	140.2	-60.1	168.7	0	0	0	117
570	P	39.2	Very low	30.7	Very low	112 Å²	112	139 Å²	139	73%	0.727	77%	0.771	S	S	*	*				-131.4	-179.9	-77.6	40.1	-24.1	0	0	0	113.7
571	M	29	Very low	30.8	Very low	182 Å²	182	140.2 Å²	140.2	90%	0.897	77%	0.766	S	S	*	*			trans	-135	152.2	163.5	-109.9	-173.1	-83.7	0	0	111.9
572	P	33.1	Very low	30.9	Very low	126 Å²	126	146.8 Å²	146.8	82%	0.818	77%	0.772	S	S	*	*			trans	-94.7	179.2	-167.7	38.9	-36.7	0	0	0	114.3
573	A	29.3	Very low	31.1	Very low	88 Å²	88	145.2 Å²	145.2	73%	0.727	76%	0.764	S	S	*	*			trans	-111.8	172.8	177.4	0	0	0	0	0	112.6
574	I	30.5	Very low	31.2	Very low	151 Å²	151	142.6 Å²	142.6	77%	0.774	75%	0.751	S	S	*	*			trans	150.6	109.5	142.2	-76.9	161.1	0	0	0	111.9
575	E	27.4	Very low	30.3	Very low	153 Å²	153	148 Å²	148	72%	0.715	76%	0.759	S	S	*	*			trans	34.1	145.3	132.6	-53.4	-178.2	150.7	0	0	125.7
576	H	29.8	Very low	30.2	Very low	156 Å²	156	149.1 Å²	149.1	72%	0.722	76%	0.758	S	S	*	*			trans	62.7	155.5	146.1	-67.3	-50.2	0	0	0	119.4
577	E	28.2	Very low	30.4	Very low	143 Å²	143	146.7 Å²	146.7	67%	0.668	76%	0.758	S	S	*	*			cis	-155.6	175	2.5	-135.7	175.1	-165.8	0	0	113.4
578	H	29.1	Very low	31.3	Very low	158 Å²	158	145.3 Å²	145.3	73%	0.731	75%	0.746	S	S	*	*			trans	33.5	134	154.7	-64.2	-42	0	0	0	124.7
579	L	28.9	Very low	31.3	Very low	154 Å²	154	147.6 Å²	147.6	81%	0.806	76%	0.755	S	S	*	*				-165.3	160.3	100.6	-130.7	84.7	0	0	0	114.1
580	N	29.6	Very low	31.2	Very low	141 Å²	141	146 Å²	146	75%	0.754	75%	0.747	S	S	*	*			trans	-125.3	152.3	177.6	-91.3	-44.7	0	0	0	111.8
581	H	29.6	Very low	30.8	Very low	172 Å²	172	148.4 Å²	148.4	80%	0.796	75%	0.748	S	S	*	*			trans	-146.3	125.3	154.5	-91.8	48.2	0	0	0	106.3
582	Y	32.2	Very low	30.8	Very low	204 Å²	204	145.9 Å²	145.9	80%	0.8	74%	0.743	S	S	*	*				58.3	135.4	58.4	-87.7	-108.9	0	0	0	113.7
583	N	31.2	Very low	30.7	Very low	134 Å²	134	145.6 Å²	145.6	72%	0.717	74%	0.739	S	S	*	*			cis	-148	177.9	0.5	-150.1	12.3	0	0	0	107.3
584	S	29.6	Very low	30.7	Very low	78 Å²	78	148.4 Å²	148.4	55%	0.545	75%	0.748	S	S	.	*			cis	-154.4	-160.8	13.5	-153.9	0	0	0	0	107.1
585	Y	27.9	Very low	30.8	Very low	219 Å²	219	146.9 Å²	146.9	86%	0.859	75%	0.745	S	S	*	*			cis	-149.3	-160.6	11.7	-128.8	-68	0	0	0	109.8
586	K	28.3	Very low	30.9	Very low	187 Å²	187	147.4 Å²	147.4	81%	0.813	75%	0.753	S	S	*	*			trans	-141.5	166.2	179.4	-69.8	-177.9	173.3	177.8	0	110.3
587	S	33.6	Very low	30.9	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	75%	0.754	S	S	*	*				160.5	-177.9	75.4	56.2	0	0	0	0	110.1
588	P	48.5	Very low	31	Very low	95 Å²	95	146.6 Å²	146.6	62%	0.617	76%	0.761	S	S	*	*				-134.1	171.3	-51.2	34.6	-17.7	0	0	0	113.8
589	F	29.5	Very low	31	Very low	190 Å²	190	146 Å²	146	83%	0.833	76%	0.763	S	S	*	*				175.4	105.6	119.2	-107	-79.2	0	0	0	115.4
590	N	30	Very low	31	Very low	115 Å²	115	143.1 Å²	143.1	62%	0.615	76%	0.756	S	S	*	*			trans	19	135.9	144.9	-65.9	7.9	0	0	0	126.4
591	H	32.6	Very low	31	Very low	163 Å²	163	143.1 Å²	143.1	76%	0.755	76%	0.755	S	S	*	*			trans	66.8	154.6	137.5	-63.7	-48	0	0	0	120.2
592	T	28.2	Very low	31	Very low	130 Å²	130	143.3 Å²	143.3	80%	0.798	76%	0.756	S	S	*	*			cis	-143	167.1	10.1	-22.3	0	0	0	0	112.9
593	T	29.8	Very low	30.8	Very low	119 Å²	119	137.8 Å²	137.8	73%	0.73	75%	0.747	S	S	*	*			trans	-78.1	156.2	177	10.7	0	0	0	0	115
594	T	29.4	Very low	30.7	Very low	147 Å²	147	136.5 Å²	136.5	90%	0.902	75%	0.748	S	S	*	*			trans	-162.8	155.6	130.1	5.3	0	0	0	0	112
595	V	33.5	Very low	30.8	Very low	119 Å²	119	138.7 Å²	138.7	72%	0.721	76%	0.758	S	S	*	*			trans	-127.3	144.8	176.6	172.2	0	0	0	0	108
596	N	29	Very low	30.9	Very low	165 Å²	165	137 Å²	137	88%	0.882	76%	0.758	S	S	*	*			trans	-159	144.6	153.5	-103.7	-28.9	0	0	0	111.6
597	T	31.4	Very low	31.2	Very low	120 Å²	120	135.6 Å²	135.6	74%	0.736	75%	0.754	S	S	*	*			trans	-140.9	120.8	-173.2	47.8	0	0	0	0	110.8
598	I	30.1	Very low	31.1	Very low	162 Å²	162	136.3 Å²	136.3	83%	0.831	76%	0.756	S	S	*	*			trans	-144.1	119.3	163.5	-54.9	-176.3	0	0	0	110.4
599	N	29.4	Very low	30.2	Very low	144 Å²	144	139.2 Å²	139.2	77%	0.77	77%	0.765	S	S	*	*			trans	5	153.2	135	-56.8	-7.2	0	0	0	118.7
600	S	28.6	Very low	30	Very low	94 Å²	94	138.2 Å²	138.2	66%	0.657	77%	0.768	S	S	*	*			cis	-173.4	164.7	0.9	-115.1	0	0	0	0	112.5
601	I	28.8	Very low	29.9	Very low	142 Å²	142	140.3 Å²	140.3	73%	0.728	78%	0.778	S	S	*	*			trans	58	111.2	149.3	-57.9	156.7	0	0	0	118.8
602	H	29.3	Very low	29.6	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.815	78%	0.782	S	S	*	*				-161.3	155.7	111.5	-120.8	-80.2	0	0	0	115
603	S	28.6	Very low	29.5	Very low	87 Å²	87	145.6 Å²	145.6	61%	0.608	79%	0.786	S	S	*	*			trans	-55	170.3	-171.3	51.1	0	0	0	0	122.1
604	S	29.2	Very low	29.3	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	79%	0.79	S	S	*	*			trans	70.2	122.2	162.5	52.2	0	0	0	0	117.8
605	V	31.6	Very low	29.4	Very low	124 Å²	124	145.1 Å²	145.1	75%	0.752	78%	0.782	S	S	*	*			cis	96.9	107.5	25	178.7	0	0	0	0	114.7
606	H	30.1	Very low	29.3	Very low	184 Å²	184	148.5 Å²	148.5	85%	0.852	79%	0.787	S	S	*	*				-157.6	150.9	124.1	-109.8	-68.5	0	0	0	110.7
607	E	34	Very low	29.3	Very low	158 Å²	158	148.3 Å²	148.3	74%	0.738	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-98.4	158.6	-171.5	-58.7	164.7	102.2	0	0	113.8
608	P	32.7	Very low	29.3	Very low	121 Å²	121	150.1 Å²	150.1	79%	0.786	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-95.6	127.5	147.8	34.2	-26.1	0	0	0	111	L610	P608-L610 PolarHBondContact O-N 2.99Å
609	L	28.2	Very low	29.2	Very low	156 Å²	156	149.5 Å²	149.5	82%	0.817	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-72.1	124.6	178.8	-82.2	164.4	0	0	0	112.5
610	L	26.7	Very low	29.4	Very low	170 Å²	170	150.9 Å²	150.9	89%	0.89	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-93	121.9	165.3	-85.9	164.1	0	0	0	110.1	P608	P608-L610 PolarHBondContact O-N 2.99Å
611	I	26.7	Very low	29.4	Very low	159 Å²	159	154.1 Å²	154.1	82%	0.815	80%	0.801	S	S	*	*			trans	-115.8	126.5	162.5	-62	-177.9	0	0	0	108.7
612	R	26.7	Very low	29.4	Very low	222 Å²	222	153.1 Å²	153.1	84%	0.838	80%	0.797	S	S	*	*			trans	-124	127.8	-176.4	179.2	-168.7	-168.6	-177.7	6.6	107.3
613	M	25.2	Very low	29.5	Very low	182 Å²	182	153 Å²	153	90%	0.897	80%	0.797	S	S	*	*			trans	-137.5	145.7	174.6	-147.7	65.9	153.6	0	0	110.2
614	N	26.9	Very low	29.9	Very low	150 Å²	150	160.6 Å²	160.6	80%	0.802	83%	0.828	S	S	*	*			trans	-94.2	178	-171.2	-91.3	-6.8	0	0	0	113.2
615	S	31	Very low	29.9	Very low	105 Å²	105	163.3 Å²	163.3	73%	0.734	83%	0.832	S	S	*	*			trans	-88.7	166	-176.9	54.5	0	0	0	0	114.5
616	K	32	Very low	29.8	Very low	190 Å²	190	165.3 Å²	165.3	83%	0.826	84%	0.836	S	S	*	*			trans	71.1	125.4	170.3	-65.1	-176.8	173	-177	0	117.4
617	D	28.8	Very low	29.8	Very low	161 Å²	161	164.3 Å²	164.3	86%	0.861	84%	0.836	S	S	*	*				-151.6	164.2	104.5	-107.7	-30.6	0	0	0	111.5
618	N	30.6	Very low	29.5	Very low	159 Å²	159	164.6 Å²	164.6	85%	0.85	84%	0.841	S	S	*	*			trans	-105	127.7	177.3	-74.8	-17.9	0	0	0	110.5
619	V	29.1	Very low	29.3	Very low	149 Å²	149	167.4 Å²	167.4	90%	0.903	85%	0.845	S	S	*	*			trans	-138.3	147.5	159.1	-178.1	0	0	0	0	109.2
620	Q	32.1	Very low	29.4	Very low	172 Å²	172	168.1 Å²	168.1	80%	0.804	85%	0.847	S	S	*	*			trans	-114.4	169.9	-177.1	-178.4	174.7	-18.1	0	0	109.5
621	E	30.1	Very low	29.6	Very low	163 Å²	163	168 Å²	168	76%	0.762	84%	0.843	S	S	*	*			trans	79.3	154	-179.9	-53.2	-165.8	163.9	0	0	115.3
622	N	28.6	Very low	29.8	Very low	121 Å²	121	168.7 Å²	168.7	65%	0.647	85%	0.846	S	S	*	*			cis	-142.1	-178.5	4.6	-137.4	-39.2	0	0	0	113.7
623	Q	31.5	Very low	30.1	Very low	174 Å²	174	164.3 Å²	164.3	81%	0.813	85%	0.846	S	S	*	*			trans	-60.9	146.2	-174	-62.1	162.5	-20.1	0	0	115.6
624	I	35.5	Very low	30.5	Very low	245 Å²	245	162.6 Å²	162.6	100%	1.256	84%	0.842	S	S	*	*				-149.8	0	100.1	-92.1	165.1	0	0	0	108.3

Retrieved 624 of 624 residues in 983.9 ms (Link to these results)

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