A0A061I1L9_CRIGR Loading...

Junctional adhesion molecule C

Promotes chemotaxis of vascular endothelial cells and stimulates angiogenesis.

AlphaFold DB , UniProt , Accession A0A061I1L9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Jam3, Length 310 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	42.8	Very low	39	Very low	243 Å²	243	182.8 Å²	182.8	100%	1.197	87%	0.87	S	S	*	*				0	104.9	0	-78	171.6	-171.5	0	0	107.8
2	A	35.9	Very low	39.3	Very low	108 Å²	108	178.1 Å²	178.1	89%	0.893	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-84.1	123.2	-169.7	0	0	0	0	0	110.8
3	L	37.3	Very low	39.4	Very low	172 Å²	172	169.2 Å²	169.2	90%	0.901	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-81.7	126.7	171.8	-104.2	93.4	0	0	0	110.5	R5	L3-R5 PolarHBondContact O-N 3.18Å
4	S	34.7	Very low	39.9	Very low	104 Å²	104	173.9 Å²	173.9	73%	0.727	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-55.7	116.9	176.4	-178.6	0	0	0	0	112.8
5	R	40.1	Very low	40.6	Very low	232 Å²	232	172.6 Å²	172.6	88%	0.875	85%	0.851	S	S	*	*			trans	-90.9	108.1	160	-81.9	-175.8	174	-168.8	-1.3	108.7	L3 L7	L3-R5 PolarHBondContact O-N 3.18Å; R5-L7 PolarHBondContact O-N 3.06Å
6	R	40.8	Very low	41.2	Very low	233 Å²	233	166.9 Å²	166.9	88%	0.879	83%	0.831	S	S	*	*			trans	-79.2	101.8	165.7	-72.4	-173.3	-176	-145.8	2.4	109.1
7	L	39	Very low	41.8	Very low	141 Å²	141	165.2 Å²	165.2	74%	0.738	83%	0.825	S	S	*	*			trans	-82	118.5	163.8	-127.1	85	0	0	0	108.4	R5 L9	R5-L7 PolarHBondContact O-N 3.06Å; L7-L9 HydrophobicContact CD2-CD1 4.31Å; L7-L9 PolarHBondContact O-N 2.96Å
8	R	40.1	Very low	42.1	Very low	248 Å²	248	164.9 Å²	164.9	94%	0.936	82%	0.818	S	S	*	*			trans	-72.4	106.2	166.3	-72.7	-178.7	-179.7	-173.3	-0.6	108.1
9	L	36.2	Very low	42.4	Very low	133 Å²	133	164.8 Å²	164.8	70%	0.696	81%	0.813	S	S	*	*			trans	-94.1	113	159.6	-101.2	110.7	0	0	0	108.8	L7 L11	L7-L9 HydrophobicContact CD2-CD1 4.31Å; L7-L9 PolarHBondContact O-N 2.96Å; L9-L11 HydrophobicContact CD2-CD1 4.07Å; L9-L11 PolarHBondContact O-N 3.44Å
10	R	42.5	Very low	42.5	Very low	243 Å²	243	162.7 Å²	162.7	92%	0.917	80%	0.804	S	S	*	*			trans	-71.7	110.7	159.7	-71.5	-178.2	179.8	-161.8	0.1	107
11	L	39.3	Very low	42.6	Very low	154 Å²	154	160.8 Å²	160.8	81%	0.806	80%	0.797	S	S	*	*			trans	-100	97.6	153.1	-96.1	98.8	0	0	0	107.8	L9	L9-L11 HydrophobicContact CD2-CD1 4.07Å; L9-L11 PolarHBondContact O-N 3.44Å
12	C	43	Very low	42.8	Very low	126 Å²	126	154.7 Å²	154.7	85%	0.851	77%	0.768	S	S	*	*			trans	-76.4	112.5	160.7	-166.1	0	0	0	0	106.4
13	G	41.3	Very low	43.3	Very low	63 Å²	63	156.3 Å²	156.3	65%	0.649	76%	0.761	S	S	*	*			trans	-150.3	73.2	174.2	0	0	0	0	0	108.1	L15	G13-L15 PolarHBondContact O-N 2.85Å; G13-L15 VanDerWaalsContact O-N 3.11Å
14	R	46.3	Very low	43.8	Very low	235 Å²	235	156.4 Å²	156.4	89%	0.887	76%	0.755	S	S	*	*			trans	-57.6	111.6	163.7	-78.2	179.4	173.7	173.3	-3.8	106.5
15	L	50.5	Low	44.3	Very low	154 Å²	154	161.9 Å²	161.9	81%	0.806	76%	0.759	S	S	*	*			trans	-56.4	129	157.8	-90.3	96.3	0	0	0	106.4	G13 D17	G13-L15 PolarHBondContact O-N 2.85Å; G13-L15 VanDerWaalsContact O-N 3.11Å; L15-D17 PolarHBondContact O-N 3.04Å
16	P	49.8	Very low	44.9	Very low	82 Å²	82	153.5 Å²	153.5	53%	0.532	75%	0.746	S	S	.	*			trans	-69.4	130.2	178.8	28.1	-30.7	0	0	0	108.5	F18 F19	P16-F18 HydrophobicContact CB-CB 4.32Å; P16-F18 PolarHBondContact O-N 3.41Å; P16-F19 PolarHBondContact O-N 3.44Å
17	D	51.3	Low	45.4	Very low	138 Å²	138	147.9 Å²	147.9	74%	0.738	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-52.2	-4.2	170.4	-73.1	-44.8	0	0	0	114	L15 F19 L20	L15-D17 PolarHBondContact O-N 3.04Å; D17-F19 VanDerWaalsContact C-N 3.32Å; D17-F19 PolarHBondContact O-N 3.12Å; D17-L20 PolarHBondContact O-N 3.39Å
18	F	48	Very low	46.1	Very low	159 Å²	159	147.8 Å²	147.8	70%	0.697	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-63.5	-28.2	174.6	-99.7	-89.1	0	0	0	114.5	P16	P16-F18 HydrophobicContact CB-CB 4.32Å; P16-F18 PolarHBondContact O-N 3.41Å
19	F	46.2	Very low	47	Very low	163 Å²	163	141.6 Å²	141.6	72%	0.715	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-80.1	-20.9	179.5	-98.8	-82.6	0	0	0	113.6	P16 D17	P16-F19 PolarHBondContact O-N 3.44Å; D17-F19 VanDerWaalsContact C-N 3.32Å; D17-F19 PolarHBondContact O-N 3.12Å
20	L	44.7	Very low	48.7	Very low	123 Å²	123	138.3 Å²	138.3	64%	0.644	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-25.1	174.1	-128.6	86.5	0	0	0	112.4	D17 L22 L23	D17-L20 PolarHBondContact O-N 3.39Å; L20-L22 VanDerWaalsContact C-N 3.26Å; L20-L22 PolarHBondContact O-N 2.88Å; L20-L23 PolarHBondContact O-N 3.41Å
21	L	44.3	Very low	50.5	Low	123 Å²	123	127.8 Å²	127.8	64%	0.644	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-13.8	177	-77.5	161.5	0	0	0	113.7
22	L	47.4	Very low	53	Low	114 Å²	114	120.4 Å²	120.4	60%	0.597	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-14	176	-82.9	158.8	0	0	0	113.8	L20	L20-L22 VanDerWaalsContact C-N 3.26Å; L20-L22 PolarHBondContact O-N 2.88Å
23	L	46.7	Very low	55.4	Low	143 Å²	143	117.7 Å²	117.7	75%	0.749	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-8.8	177.4	-69.2	172	0	0	0	113.4	L20	L20-L23 PolarHBondContact O-N 3.41Å
24	F	47.2	Very low	57.9	Low	173 Å²	173	115.2 Å²	115.2	76%	0.759	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	30.9	174	-64.3	-78.2	0	0	0	112.2	G26	F24-G26 PolarHBondContact O-N 2.85Å
25	R	46.8	Very low	60.3	Low	219 Å²	219	110.3 Å²	110.3	83%	0.826	57%	0.566	S	S	*	*	S	Bend	trans	-66	86.9	150.9	-119.3	-173.1	-178.6	-162.6	-0.4	105.3	C27	R25-C27 PolarHBondContact O-N 2.76Å
26	G	50.9	Low	62.5	Low	57 Å²	57	103.7 Å²	103.7	59%	0.588	53%	0.532	S	S	*	.			trans	-42.1	130.1	176.9	0	0	0	0	0	108	F24 L28	F24-G26 PolarHBondContact O-N 2.85Å; G26-L28 PolarHBondContact O-N 2.73Å
27	C	52.4	Low	64.7	Low	114 Å²	114	104.2 Å²	104.2	77%	0.77	54%	0.538	S	S	*	.			trans	-56.7	87.2	172.1	-164.6	0	0	0	0	106.8	R25 I29	R25-C27 PolarHBondContact O-N 2.76Å; C27-I29 VanDerWaalsContact C-N 3.28Å; C27-I29 PolarHBondContact O-N 2.86Å
28	L	54.1	Low	66.9	Low	140 Å²	140	101.4 Å²	101.4	73%	0.733	52%	0.523	S	S	*	.			trans	-66.3	103.6	162.8	-72.7	171.6	0	0	0	102.8	G26 E30	G26-L28 PolarHBondContact O-N 2.73Å; L28-E30 PolarHBondContact O-N 2.92Å
29	I	59.2	Low	69.3	Low	118 Å²	118	100.1 Å²	100.1	61%	0.605	51%	0.513	S	S	*	.			trans	-68.4	90.2	176.8	-63.1	170.7	0	0	0	104.6	C27 A31	C27-I29 VanDerWaalsContact C-N 3.28Å; C27-I29 PolarHBondContact O-N 2.86Å; I29-A31 HydrophobicContact CG2-CB 3.98Å; I29-A31 PolarHBondContact O-N 2.82Å
30	E	70.4	Confident	71.8	Confident	63 Å²	63	96.4 Å²	96.4	29%	0.294	50%	0.501	S	S	.	.			trans	-76	61.9	178.1	-64.7	-179.9	-176.9	0	0	109.3	L28 R123	L28-E30 PolarHBondContact O-N 2.92Å; E30-R123 HydrophobicContact CB-CG 3.83Å; E30-R123 VanDerWaalsContact CD-NH2 3.28Å; E30-R123 WeakPolarHBondContact O-CA 3.38Å; E30-R123 WeakPolarHBondContact O-CB 3.28Å; E30-R123 WeakPolarHBondContact O-CG 3.4Å; E30-R123 PolarHBondContact O-N 2.79Å; E30-R123 IonicContact OE1-NH2 2.71Å; E30-R123 PolarHBondContact OE1-NH2 3.18Å; E30-R123 IonicContact OE2-CZ 3.97Å; E30-R123 IonicContact OE2-NE 3.65Å; E30-R123 PolarHBondContact OE2-NE 3.02Å; E30-R123 IonicContact OE2-NH2 3.3Å; E30-R123 PolarHBondContact OE2-NH2 3.18Å
31	A	81.6	Confident	74.3	Confident	22 Å²	22	90.9 Å²	90.9	18%	0.182	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-147.8	139.2	-174.9	0	0	0	0	0	110.3	I29 N33 K124	I29-A31 HydrophobicContact CG2-CB 3.98Å; I29-A31 PolarHBondContact O-N 2.82Å; A31-N33 PolarHBondContact O-N 2.71Å; A31-K124 HydrophobicContact CB-CB 3.6Å
32	V	91.9	Very high	76.9	Confident	0 Å²	0	88.7 Å²	88.7	0%	0	46%	0.464	C	S	.	.			trans	-67.4	128.5	171.5	67.8	0	0	0	0	109.8	I55 D57 V117 A119 D122 K124 D127	V32-I55 HydrophobicContact CG2-CG2 4.48Å; V32-D57 WeakPolarHBondContact CA-O 3.37Å; V32-V117 HydrophobicContact CG2-CB 4.48Å; V32-V117 HydrophobicContact CG2-CG1 4Å; V32-A119 HydrophobicContact CB-CB 3.82Å; V32-A119 HydrophobicContact CG1-CB 4.26Å; V32-A119 HydrophobicContact CG2-CB 4.11Å; V32-D122 PolarHBondContact N-OD2 3.47Å; V32-K124 WeakPolarHBondContact CG1-O 3.42Å; V32-K124 PolarHBondContact N-O 2.97Å; V32-D127 HydrophobicContact CG1-CB 3.74Å
33	N	92.4	Very high	79.3	Confident	69 Å²	69	83.7 Å²	83.7	37%	0.369	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.1	178	-163	-77.9	0	0	0	110.8	A31 I55 T56 D57 D127	A31-N33 PolarHBondContact O-N 2.71Å; N33-I55 WeakPolarHBondContact O-CA 3.4Å; N33-T56 WeakPolarHBondContact CB-OG1 3.4Å; N33-T56 PolarHBondContact O-N 3.04Å; N33-T56 PolarHBondContact O-OG1 2.83Å; N33-T56 PolarHBondContact OD1-OG1 2.99Å; N33-D57 HydrophobicContact CB-CB 4.23Å; N33-D57 PolarHBondContact N-O 3.17Å; N33-D127 WeakPolarHBondContact CA-OD2 3.42Å
34	L	94.9	Very high	81.7	Confident	11 Å²	11	80.5 Å²	80.5	6%	0.058	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	141.8	177.5	-57.4	179.4	0	0	0	111.1	I54 I55 V117 D127 I129	L34-I54 CarbonylContact C-O 3.47Å; L34-I54 WeakPolarHBondContact CA-O 3.22Å; L34-I55 HydrophobicContact CD2-CB 4.29Å; L34-I55 HydrophobicContact CD2-CG1 3.63Å; L34-V117 HydrophobicContact CD1-CB 4.07Å; L34-V117 HydrophobicContact CD1-CG2 3.87Å; L34-V117 HydrophobicContact CD2-CB 3.97Å; L34-V117 HydrophobicContact CD2-CG2 3.67Å; L34-V117 HydrophobicContact CG-CB 4.49Å; L34-V117 HydrophobicContact CG-CG2 4.39Å; L34-D127 HydrophobicContact CD1-CB 4.06Å; L34-D127 VanDerWaalsContact CD1-O 3.29Å; L34-D127 WeakPolarHBondContact CD1-O 3.38Å; L34-D127 HydrophobicContact CG-CB 3.93Å; L34-D127 PolarHBondContact N-OD2 3.38Å; L34-I129 HydrophobicContact CB-CD1 3.51Å; L34-I129 HydrophobicContact CB-CG1 3.69Å; L34-I129 HydrophobicContact CD1-CG1 4.35Å
35	K	95.8	Very high	84.1	Confident	131 Å²	131	73.9 Å²	73.9	57%	0.57	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.3	169.3	-172.5	176.3	178.3	-177.4	0	110.7	I54 T56	K35-I54 PolarHBondContact N-O 3.36Å; K35-I54 WeakPolarHBondContact O-CB 3.44Å; K35-I54 PolarHBondContact O-N 3.29Å; K35-T56 HydrophobicContact CB-CG2 3.64Å; K35-T56 HydrophobicContact CD-CG2 4.36Å
36	S	97	Very high	86.4	Confident	15 Å²	15	69.9 Å²	69.9	11%	0.105	38%	0.38	C	S	.	.			trans	-119.3	139.2	170.1	168.6	0	0	0	0	109	N38 S52	S36-N38 VanDerWaalsContact OG-C 3.23Å; S36-N38 PolarHBondContact OG-N 3.05Å; S36-N38 PolarHBondContact OG-O 3.09Å; S36-S52 WeakPolarHBondContact CA-O 3.45Å; S36-S52 WeakPolarHBondContact CB-O 3.25Å; S36-S52 PolarHBondContact OG-O 2.87Å; S36-S52 VanDerWaalsContact OG-O 3.06Å; S36-S52 PolarHBondContact OG-OG 2.97Å
37	S	96.3	Very high	88.6	Confident	94 Å²	94	72.1 Å²	72.1	66%	0.657	38%	0.375	S	S	*	.	S	Bend	trans	-75.4	-32.6	173	50.6	0	0	0	0	111.9	S52	S37-S52 PolarHBondContact N-OG 2.86Å; S37-S52 WeakPolarHBondContact OG-CB 3.46Å; S37-S52 PolarHBondContact OG-OG 2.69Å
38	N	97.3	Very high	90.8	Very high	78 Å²	78	69.4 Å²	69.4	42%	0.417	36%	0.357	S	S	.	.			trans	-144.6	120.1	175.2	-170.1	-5.2	0	0	0	110.8	S36 N40 P41 S52	S36-N38 VanDerWaalsContact OG-C 3.23Å; S36-N38 PolarHBondContact OG-N 3.05Å; S36-N38 PolarHBondContact OG-O 3.09Å; N38-N40 VanDerWaalsContact OD1-C 3.26Å; N38-N40 PolarHBondContact OD1-N 3.42Å; N38-N40 PolarHBondContact OD1-O 3.2Å; N38-P41 WeakPolarHBondContact ND2-CA 3.46Å; N38-S52 PolarHBondContact N-OG 3.19Å
39	R	97.9	Very high	92.9	Very high	133 Å²	133	63.4 Å²	63.4	50%	0.502	33%	0.326	S	S	.	.	S	Bend	trans	-89.2	-12.4	177.3	-66.4	-173.4	179.4	-134.3	-0.8	113.5	P41 I131 E132	R39-P41 VanDerWaalsContact C-CD 3.47Å; R39-I131 CarbonylContact O-C 3.52Å; R39-I131 WeakPolarHBondContact O-CA 3.47Å; R39-E132 PolarHBondContact O-N 3.45Å
40	N	98	Very high	94.7	Very high	84 Å²	84	61.2 Å²	61.2	45%	0.449	31%	0.314	S	S	.	.	S	Bend	trans	-133.6	60.5	-179.6	-55.9	87.8	0	0	0	110.1	N38 V42 E132	N38-N40 VanDerWaalsContact OD1-C 3.26Å; N38-N40 PolarHBondContact OD1-N 3.42Å; N38-N40 PolarHBondContact OD1-O 3.2Å; N40-V42 PolarHBondContact O-N 3.29Å; N40-E132 WeakPolarHBondContact CA-O 3.38Å; N40-E132 PolarHBondContact ND2-OE2 2.95Å
41	P	98	Very high	96	Very high	7 Å²	7	58.2 Å²	58.2	5%	0.045	30%	0.3	C	S	.	.			trans	-63.3	133.9	176.8	27.2	-33.4	0	0	0	110.7	N38 R39 V49 L51 I131 E132 L133 I134	N38-P41 WeakPolarHBondContact ND2-CA 3.46Å; R39-P41 VanDerWaalsContact C-CD 3.47Å; P41-V49 HydrophobicContact CB-CG2 3.88Å; P41-V49 HydrophobicContact CG-CG2 4.49Å; P41-L51 HydrophobicContact CG-CD2 3.75Å; P41-I131 HydrophobicContact CG-CG2 3.68Å; P41-E132 WeakPolarHBondContact CD-O 3.31Å; P41-L133 HydrophobicContact CB-CD1 4.27Å; P41-L133 HydrophobicContact CG-CD1 3.97Å; P41-I134 PolarHBondContact O-N 3.05Å
42	V	97.8	Very high	96.7	Very high	78 Å²	78	57.2 Å²	57.2	47%	0.473	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.1	175.3	-175.3	0	0	0	0	107.3	N40 I134 Q136	N40-V42 PolarHBondContact O-N 3.29Å; V42-I134 WeakPolarHBondContact CA-O 3.34Å; V42-I134 HydrophobicContact CG2-CB 4.4Å; V42-Q136 HydrophobicContact CG1-CG 3.48Å; V42-Q136 VanDerWaalsContact CG1-CG 3.48Å
43	V	98.1	Very high	97	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.055	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	149.7	-175.8	63.2	0	0	0	0	109.9	E47 V49 V105 L133 I134 V135 Q136	V43-E47 HydrophobicContact CG2-CB 3.79Å; V43-V49 HydrophobicContact CB-CB 4.08Å; V43-V49 HydrophobicContact CB-CG2 4.19Å; V43-V49 HydrophobicContact CG1-CB 4.02Å; V43-V49 HydrophobicContact CG1-CG1 4.34Å; V43-V49 HydrophobicContact CG1-CG2 4.28Å; V43-V49 HydrophobicContact CG2-CB 4.13Å; V43-V105 HydrophobicContact CG1-CG1 4.48Å; V43-V105 HydrophobicContact CG1-CG2 3.83Å; V43-V105 HydrophobicContact CG2-CG2 4.08Å; V43-L133 HydrophobicContact CG1-CD1 3.86Å; V43-I134 PolarHBondContact N-O 3.17Å; V43-I134 VanDerWaalsContact N-O 3.08Å; V43-V135 HydrophobicContact CG1-CG2 4.03Å; V43-V135 CarbonylContact O-C 3.59Å; V43-V135 WeakPolarHBondContact O-CA 3.37Å; V43-Q136 PolarHBondContact O-N 3.34Å
44	H	97.8	Very high	97.1	Very high	75 Å²	75	57.5 Å²	57.5	35%	0.347	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	150.4	174.4	-58.3	158.9	0	0	0	111.5	F46 E47 V105 Q136	H44-F46 PolarHBondContact O-N 3.19Å; H44-E47 HydrophobicContact CB-CG 4.24Å; H44-E47 WeakPolarHBondContact O-CB 3.22Å; H44-E47 PolarHBondContact O-N 2.81Å; H44-V105 WeakPolarHBondContact O-CG2 3.48Å; H44-Q136 WeakPolarHBondContact CA-O 3.42Å
45	E	96.8	Very high	97.1	Very high	35 Å²	35	59.3 Å²	59.3	16%	0.164	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	138.9	175.4	-159	170.9	-134.9	0	0	111.3	E47 R107 V135 Q136 V137	E45-E47 VanDerWaalsContact C-N 3.27Å; E45-E47 PolarHBondContact O-N 2.81Å; E45-R107 PolarHBondContact OE1-N 3.04Å; E45-R107 IonicContact OE1-NE 3.62Å; E45-R107 PolarHBondContact OE1-NE 2.79Å; E45-R107 IonicContact OE2-NH2 3.78Å; E45-V135 HydrophobicContact CB-CG1 4.14Å; E45-V135 HydrophobicContact CG-CG1 4.44Å; E45-Q136 PolarHBondContact N-O 3.48Å; E45-V137 HydrophobicContact CB-CG2 4.38Å
46	F	96.3	Very high	96.9	Very high	135 Å²	135	56 Å²	56	59%	0.592	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	2.9	-176.4	-44.5	-65.7	0	0	0	116.7	H44 V105	H44-F46 PolarHBondContact O-N 3.19Å; F46-V105 WeakPolarHBondContact CA-O 3.49Å; F46-V105 PolarHBondContact N-O 3.3Å
47	E	97.3	Very high	96.4	Very high	104 Å²	104	59.4 Å²	59.4	49%	0.486	31%	0.309	S	S	.	.	S	Bend	trans	-87.5	-176	171	-62.8	-171.1	161.7	0	0	112.1	V43 H44 E45 N104 V105	V43-E47 HydrophobicContact CG2-CB 3.79Å; H44-E47 HydrophobicContact CB-CG 4.24Å; H44-E47 WeakPolarHBondContact O-CB 3.22Å; H44-E47 PolarHBondContact O-N 2.81Å; E45-E47 VanDerWaalsContact C-N 3.27Å; E45-E47 PolarHBondContact O-N 2.81Å; E47-N104 PolarHBondContact O-N 3.21Å; E47-N104 VanDerWaalsContact O-N 3.16Å; E47-V105 WeakPolarHBondContact O-CG2 3.43Å; E47-V105 PolarHBondContact O-N 3.36Å
48	S	97.5	Very high	96.1	Very high	57 Å²	57	57.1 Å²	57.1	40%	0.399	29%	0.293	S	S	.	.			trans	-110	142.4	175.1	63.6	0	0	0	0	111.2	I102	S48-I102 CarbonylContact C-O 3.56Å; S48-I102 WeakPolarHBondContact CA-O 3.25Å; S48-I102 WeakPolarHBondContact CB-O 3.43Å
49	V	97.9	Very high	95.6	Very high	14 Å²	14	58.5 Å²	58.5	9%	0.085	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.9	177.7	70.2	0	0	0	0	111.2	P41 V43 L51 R101 I102 V105 L133	P41-V49 HydrophobicContact CB-CG2 3.88Å; P41-V49 HydrophobicContact CG-CG2 4.49Å; V43-V49 HydrophobicContact CB-CB 4.08Å; V43-V49 HydrophobicContact CB-CG2 4.19Å; V43-V49 HydrophobicContact CG1-CB 4.02Å; V43-V49 HydrophobicContact CG1-CG1 4.34Å; V43-V49 HydrophobicContact CG1-CG2 4.28Å; V43-V49 HydrophobicContact CG2-CB 4.13Å; V49-L51 HydrophobicContact CG1-CD2 4.48Å; V49-R101 WeakPolarHBondContact O-CA 3.04Å; V49-I102 HydrophobicContact CG1-CB 4.12Å; V49-I102 PolarHBondContact N-O 2.74Å; V49-I102 PolarHBondContact O-N 2.83Å; V49-V105 HydrophobicContact CB-CG1 4.46Å; V49-V105 HydrophobicContact CG1-CG1 3.74Å; V49-L133 HydrophobicContact CB-CD1 4.39Å; V49-L133 HydrophobicContact CG1-CD1 3.92Å; V49-L133 HydrophobicContact CG1-CD2 4.04Å; V49-L133 HydrophobicContact CG2-CD1 3.9Å
50	E	97.3	Very high	95.1	Very high	72 Å²	72	53 Å²	53	34%	0.336	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.9	172.6	-175.3	175.5	147.1	0	0	110.3	F95 L100 R101	E50-F95 WeakPolarHBondContact OE2-CD1 3.4Å; E50-L100 CarbonylContact C-O 3.54Å; E50-L100 WeakPolarHBondContact CA-O 3.45Å; E50-R101 IonicContact OE2-CZ 3.35Å; E50-R101 IonicContact OE2-NE 3.37Å; E50-R101 IonicContact OE2-NH2 3.58Å; E50-R101 PolarHBondContact OE2-NH2 3.16Å
51	L	98	Very high	94.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	101.4	171.6	-53.9	-173.8	0	0	0	108.3	P41 V49 C53 W67 S99 L100 I102 Y113 I131 L133	P41-L51 HydrophobicContact CG-CD2 3.75Å; V49-L51 HydrophobicContact CG1-CD2 4.48Å; L51-C53 PolarHBondContact O-N 2.9Å; L51-W67 HydrophobicContact CB-CH2 3.7Å; L51-W67 HydrophobicContact CB-CZ3 4Å; L51-W67 HydrophobicContact CD1-CZ3 4.23Å; L51-S99 WeakPolarHBondContact O-CA 3.5Å; L51-S99 WeakPolarHBondContact O-CB 3.38Å; L51-L100 HydrophobicContact CB-CB 4.36Å; L51-L100 PolarHBondContact N-O 2.8Å; L51-L100 PolarHBondContact O-N 3.41Å; L51-L100 VanDerWaalsContact O-N 3.08Å; L51-I102 HydrophobicContact CD1-CD1 3.83Å; L51-I102 HydrophobicContact CG-CD1 4.31Å; L51-Y113 HydrophobicContact CD1-CD1 3.73Å; L51-Y113 HydrophobicContact CD1-CD2 3.79Å; L51-Y113 HydrophobicContact CD1-CE1 4.24Å; L51-Y113 HydrophobicContact CD1-CE2 4.3Å; L51-Y113 HydrophobicContact CD1-CG 3.48Å; L51-Y113 VanDerWaalsContact CD1-CG 3.48Å; L51-I131 HydrophobicContact CB-CD1 4.1Å; L51-I131 HydrophobicContact CD2-CG2 4.07Å; L51-L133 HydrophobicContact CD2-CB 4.31Å; L51-L133 HydrophobicContact CD2-CD1 4.29Å; L51-L133 HydrophobicContact CD2-CD2 4.41Å
52	S	96.9	Very high	94.1	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.007	33%	0.331	C	S	.	.			trans	-79.3	116.2	-172.7	58.8	0	0	0	0	112.2	S36 S37 N38 I131	S36-S52 WeakPolarHBondContact CA-O 3.45Å; S36-S52 WeakPolarHBondContact CB-O 3.25Å; S36-S52 PolarHBondContact OG-O 2.87Å; S36-S52 VanDerWaalsContact OG-O 3.06Å; S36-S52 PolarHBondContact OG-OG 2.97Å; S37-S52 PolarHBondContact N-OG 2.86Å; S37-S52 WeakPolarHBondContact OG-CB 3.46Å; S37-S52 PolarHBondContact OG-OG 2.69Å; N38-S52 PolarHBondContact N-OG 3.19Å; S52-I131 WeakPolarHBondContact O-CD1 3.44Å
53	C	97	Very high	93.9	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.313	C	S	.	.			trans	-129	111.6	166.8	-175.6	0	0	0	0	106.9	L51 W67 T98 S99 C115	L51-C53 PolarHBondContact O-N 2.9Å; C53-W67 HydrophobicContact CB-CH2 3.86Å; C53-W67 HydrophobicContact CB-CZ2 3.35Å; C53-T98 CarbonylContact O-C 3.56Å; C53-T98 WeakPolarHBondContact O-CB 3.02Å; C53-T98 PolarHBondContact O-OG1 2.84Å; C53-S99 PolarHBondContact N-OG 2.68Å; C53-S99 PolarHBondContact O-OG 3.24Å; C53-C115 HydrophobicContact CB-CB 3.59Å; C53-C115 WeakPolarHBondContact CB-SG 3.48Å; C53-C115 WeakPolarHBondContact SG-CB 3.21Å; C53-C115 CovalentContact SG-SG 2.04Å; C53-C115 PolarHBondContact SG-SG 3.31Å
54	I	95.2	Very high	93.7	Very high	75 Å²	75	65.9 Å²	65.9	39%	0.385	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	119.8	-169.9	-56.4	167.7	0	0	0	107.9	L34 K35 T56	L34-I54 CarbonylContact C-O 3.47Å; L34-I54 WeakPolarHBondContact CA-O 3.22Å; K35-I54 PolarHBondContact N-O 3.36Å; K35-I54 WeakPolarHBondContact O-CB 3.44Å; K35-I54 PolarHBondContact O-N 3.29Å; I54-T56 PolarHBondContact O-N 2.9Å
55	I	94.1	Very high	93.6	Very high	48 Å²	48	63.3 Å²	63.3	25%	0.246	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	115.8	171	-54.8	172	0	0	0	107.7	V32 N33 L34 P63 T98 V117	V32-I55 HydrophobicContact CG2-CG2 4.48Å; N33-I55 WeakPolarHBondContact O-CA 3.4Å; L34-I55 HydrophobicContact CD2-CB 4.29Å; L34-I55 HydrophobicContact CD2-CG1 3.63Å; I55-P63 HydrophobicContact CD1-CG 3.66Å; I55-T98 HydrophobicContact CD1-CG2 3.5Å; I55-T98 HydrophobicContact CG1-CG2 3.77Å; I55-V117 HydrophobicContact CD1-CG1 3.92Å; I55-V117 HydrophobicContact CG1-CG1 4.37Å; I55-V117 HydrophobicContact CG1-CG2 4.49Å
56	T	91.9	Very high	93.6	Very high	62 Å²	62	61.9 Å²	61.9	38%	0.38	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-36.5	176.9	62.7	0	0	0	0	111.6	N33 K35 I54	N33-T56 WeakPolarHBondContact CB-OG1 3.4Å; N33-T56 PolarHBondContact O-N 3.04Å; N33-T56 PolarHBondContact O-OG1 2.83Å; N33-T56 PolarHBondContact OD1-OG1 2.99Å; K35-T56 HydrophobicContact CB-CG2 3.64Å; K35-T56 HydrophobicContact CD-CG2 4.36Å; I54-T56 PolarHBondContact O-N 2.9Å
57	D	87.6	Confident	93.7	Very high	86 Å²	86	55.5 Å²	55.5	46%	0.46	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	130.9	-175.5	-58.6	-82.2	0	0	0	109.1	V32 N33	V32-D57 WeakPolarHBondContact CA-O 3.37Å; N33-D57 HydrophobicContact CB-CB 4.23Å; N33-D57 PolarHBondContact N-O 3.17Å
58	S	89.3	Confident	93.7	Very high	46 Å²	46	51.5 Å²	51.5	32%	0.322	27%	0.269	S	S	.	.			trans	-165.4	150.3	167.7	-173.3	0	0	0	0	110.6	T60 D122	S58-T60 PolarHBondContact OG-N 3.33Å; S58-D122 WeakPolarHBondContact CA-OD2 3.4Å; S58-D122 WeakPolarHBondContact CB-OD2 3.41Å; S58-D122 PolarHBondContact OG-OD1 3.2Å; S58-D122 PolarHBondContact OG-OD2 2.91Å
59	Q	86.6	Confident	93.7	Very high	108 Å²	108	49 Å²	49	51%	0.505	25%	0.251	S	S	.	.	S	Bend	trans	-95.9	-15.1	169.2	-67.5	-156.1	96.6	0	0	112.8	N61 D122	Q59-N61 PolarHBondContact O-N 2.66Å; Q59-D122 PolarHBondContact N-OD1 3.39Å; Q59-D122 PolarHBondContact N-OD2 2.71Å
60	T	87.6	Confident	93.7	Very high	17 Å²	17	50.4 Å²	50.4	10%	0.104	26%	0.258	C	S	.	.			trans	-76.2	119.3	177.7	-58.3	0	0	0	0	109.5	S58 D62 P63 A119 N121 D122	S58-T60 PolarHBondContact OG-N 3.33Å; T60-D62 VanDerWaalsContact C-N 3.31Å; T60-D62 PolarHBondContact O-N 3.46Å; T60-P63 HydrophobicContact CG2-CB 4.19Å; T60-A119 HydrophobicContact CG2-CB 4.41Å; T60-A119 WeakPolarHBondContact OG1-CA 3.13Å; T60-A119 WeakPolarHBondContact OG1-CB 3.22Å; T60-N121 WeakPolarHBondContact OG1-CB 3.48Å; T60-N121 PolarHBondContact OG1-N 2.9Å; T60-D122 PolarHBondContact N-OD1 2.78Å; T60-D122 PolarHBondContact OG1-OD1 2.81Å
61	N	87.1	Confident	93.6	Very high	166 Å²	166	49.9 Å²	49.9	89%	0.888	26%	0.255	S	S	*	.	S	Bend	trans	-68.7	-29.2	-178.9	-72.1	-39.5	0	0	0	113.5	Q59	Q59-N61 PolarHBondContact O-N 2.66Å
62	D	88.9	Confident	93.3	Very high	133 Å²	133	57.8 Å²	57.8	71%	0.711	30%	0.298	S	S	*	.	S	Bend	trans	-136	75	-178.4	-171.1	37.9	0	0	0	110	T60	T60-D62 VanDerWaalsContact C-N 3.31Å; T60-D62 PolarHBondContact O-N 3.46Å
63	P	93.4	Very high	93	Very high	15 Å²	15	61.4 Å²	61.4	10%	0.097	34%	0.335	C	S	.	.			trans	-74.4	144.9	179.1	31.9	-33.3	0	0	0	110.3	I55 T60 I65 V117 V118 A119	I55-P63 HydrophobicContact CD1-CG 3.66Å; T60-P63 HydrophobicContact CG2-CB 4.19Å; P63-I65 PolarHBondContact O-N 3.29Å; P63-V117 HydrophobicContact CB-CG1 3.69Å; P63-V117 HydrophobicContact CG-CG1 4.1Å; P63-V118 CarbonylContact C-O 3.43Å; P63-V118 WeakPolarHBondContact CA-O 3.29Å; P63-A119 HydrophobicContact CB-CB 4.17Å
64	R	94.3	Very high	92.9	Very high	135 Å²	135	67.9 Å²	67.9	51%	0.509	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123.4	177.8	-172	175.9	78.8	-151.1	2.9	109.5	E66 V117 V118	R64-E66 HydrophobicContact CG-CG 4.48Å; R64-E66 IonicContact CZ-OE1 3.17Å; R64-E66 IonicContact NE-OE1 2.76Å; R64-E66 PolarHBondContact NE-OE1 2.76Å; R64-E66 IonicContact NH2-OE1 3.81Å; R64-E66 PolarHBondContact NH2-OE1 3.12Å; R64-V117 WeakPolarHBondContact O-CA 3.37Å; R64-V118 HydrophobicContact CB-CB 4.29Å; R64-V118 PolarHBondContact N-O 3.42Å; R64-V118 PolarHBondContact O-N 3.35Å
65	I	95.5	Very high	92.9	Very high	20 Å²	20	67.8 Å²	67.8	10%	0.103	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.6	-179.1	-59.8	133.4	0	0	0	109.1	P63 Y79 K97 T98 V117	P63-I65 PolarHBondContact O-N 3.29Å; I65-Y79 HydrophobicContact CB-CE1 4.17Å; I65-Y79 HydrophobicContact CG2-CD1 4.24Å; I65-Y79 HydrophobicContact CG2-CE1 4.26Å; I65-Y79 WeakPolarHBondContact O-CD1 3.46Å; I65-K97 WeakPolarHBondContact CD1-O 3.16Å; I65-T98 HydrophobicContact CD1-CG2 3.63Å; I65-T98 HydrophobicContact CG1-CG2 3.72Å; I65-V117 HydrophobicContact CG1-CG2 4.17Å
66	E	96.5	Very high	93	Very high	6 Å²	6	67.8 Å²	67.8	3%	0.028	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.9	177.5	-52.3	-176.2	-172.3	0	0	109.4	R64 K68 Y79 F80 E116	R64-E66 HydrophobicContact CG-CG 4.48Å; R64-E66 IonicContact CZ-OE1 3.17Å; R64-E66 IonicContact NE-OE1 2.76Å; R64-E66 PolarHBondContact NE-OE1 2.76Å; R64-E66 IonicContact NH2-OE1 3.81Å; R64-E66 PolarHBondContact NH2-OE1 3.12Å; E66-K68 VanDerWaalsContact OE2-CE 3.22Å; E66-K68 WeakPolarHBondContact OE2-CE 3.36Å; E66-K68 IonicContact OE2-NZ 2.82Å; E66-K68 PolarHBondContact OE2-NZ 2.79Å; E66-Y79 WeakPolarHBondContact CA-O 3.44Å; E66-F80 HydrophobicContact CG-CD2 3.86Å; E66-F80 HydrophobicContact CG-CE2 4.25Å; E66-E116 HydrophobicContact CB-CB 4.42Å; E66-E116 PolarHBondContact N-O 2.8Å; E66-E116 PolarHBondContact O-N 3.37Å
67	W	98.1	Very high	93.3	Very high	1 Å²	1	69.4 Å²	69.4	0%	0.004	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.1	167.6	-77.2	87.8	0	0	0	110.7	L51 C53 V78 Y79 T98 L100 R114 C115 I131	L51-W67 HydrophobicContact CB-CH2 3.7Å; L51-W67 HydrophobicContact CB-CZ3 4Å; L51-W67 HydrophobicContact CD1-CZ3 4.23Å; C53-W67 HydrophobicContact CB-CH2 3.86Å; C53-W67 HydrophobicContact CB-CZ2 3.35Å; W67-V78 HydrophobicContact CB-CB 4.08Å; W67-V78 PolarHBondContact O-N 2.73Å; W67-Y79 PolarHBondContact N-O 2.79Å; W67-Y79 PolarHBondContact O-N 3.08Å; W67-T98 WeakPolarHBondContact CZ2-O 3.4Å; W67-T98 PolarHBondContact NE1-O 2.78Å; W67-L100 HydrophobicContact CB-CD1 3.67Å; W67-L100 HydrophobicContact CB-CG 4.49Å; W67-L100 HydrophobicContact CD2-CD1 3.44Å; W67-L100 VanDerWaalsContact CD2-CD1 3.44Å; W67-L100 HydrophobicContact CD2-CG 3.73Å; W67-L100 HydrophobicContact CE3-CD1 3.81Å; W67-L100 HydrophobicContact CE3-CG 4.38Å; W67-L100 HydrophobicContact CG-CD1 3.39Å; W67-L100 HydrophobicContact CG-CD2 4.36Å; W67-L100 HydrophobicContact CG-CG 3.77Å; W67-L100 HydrophobicContact CZ2-CG 4.16Å; W67-R114 WeakPolarHBondContact CA-O 2.94Å; W67-C115 HydrophobicContact CD2-CB 3.97Å; W67-C115 HydrophobicContact CE3-CB 4.03Å; W67-C115 HydrophobicContact CH2-CB 3.78Å; W67-C115 HydrophobicContact CZ2-CB 3.69Å; W67-C115 HydrophobicContact CZ3-CB 3.93Å; W67-I131 HydrophobicContact CH2-CD1 3.76Å; W67-I131 HydrophobicContact CZ3-CD1 4.14Å
68	K	97.5	Very high	93.8	Very high	19 Å²	19	65.4 Å²	65.4	8%	0.083	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134.1	-179.3	-65.7	164.5	-173.1	160.2	0	109.2	E66 T75 T76 Y77 Y113 R114 E116	E66-K68 VanDerWaalsContact OE2-CE 3.22Å; E66-K68 WeakPolarHBondContact OE2-CE 3.36Å; E66-K68 IonicContact OE2-NZ 2.82Å; E66-K68 PolarHBondContact OE2-NZ 2.79Å; K68-T75 HydrophobicContact CB-CG2 3.84Å; K68-T75 HydrophobicContact CD-CG2 4.25Å; K68-T75 HydrophobicContact CG-CG2 4.21Å; K68-T76 CarbonylContact C-O 3.48Å; K68-T76 VanDerWaalsContact CA-O 3.22Å; K68-T76 WeakPolarHBondContact CA-O 3.15Å; K68-Y77 HydrophobicContact CD-CE1 4.21Å; K68-Y77 HydrophobicContact CG-CD1 3.92Å; K68-Y77 HydrophobicContact CG-CE1 3.99Å; K68-Y113 CarbonylContact O-C 3.6Å; K68-Y113 WeakPolarHBondContact O-CA 3.45Å; K68-R114 PolarHBondContact N-O 2.82Å; K68-R114 PolarHBondContact O-N 3.36Å; K68-E116 IonicContact NZ-OE2 2.71Å; K68-E116 PolarHBondContact NZ-OE2 2.88Å
69	K	97.7	Very high	94.1	Very high	5 Å²	5	64.3 Å²	64.3	2%	0.022	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	125.4	169.4	-175.7	-174.3	-172.9	-165.7	0	108.1	T75 T76 V78 D87 S108 A111 Y113	K69-T75 CarbonylContact O-C 3.52Å; K69-T75 WeakPolarHBondContact O-CA 3.4Å; K69-T76 PolarHBondContact N-O 2.93Å; K69-T76 PolarHBondContact O-N 3.41Å; K69-V78 HydrophobicContact CB-CG2 3.61Å; K69-D87 IonicContact NZ-OD2 2.83Å; K69-D87 PolarHBondContact NZ-OD2 2.85Å; K69-S108 PolarHBondContact NZ-O 3.4Å; K69-A111 HydrophobicContact CD-CB 4.37Å; K69-A111 HydrophobicContact CG-CB 3.76Å; K69-Y113 HydrophobicContact CB-CD1 4.22Å; K69-Y113 HydrophobicContact CB-CE1 3.94Å; K69-Y113 HydrophobicContact CD-CE1 4.22Å; K69-Y113 WeakPolarHBondContact CE-OH 3.46Å; K69-Y113 HydrophobicContact CG-CD1 4.41Å; K69-Y113 HydrophobicContact CG-CE1 3.84Å
70	I	97.5	Very high	94.6	Very high	43 Å²	43	62.2 Å²	62.2	22%	0.221	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111	-179.7	-53.4	167.3	0	0	0	107.2	Q74 T75 I112 R114	I70-Q74 WeakPolarHBondContact CA-O 3.33Å; I70-T75 HydrophobicContact CG1-CG2 4.14Å; I70-I112 WeakPolarHBondContact CA-O 3.43Å; I70-I112 HydrophobicContact CB-CB 4.24Å; I70-I112 WeakPolarHBondContact CB-O 3.2Å; I70-I112 HydrophobicContact CD1-CG2 4.36Å; I70-I112 PolarHBondContact N-O 2.88Å; I70-I112 PolarHBondContact O-N 2.78Å; I70-I112 VanDerWaalsContact O-N 3.07Å; I70-R114 HydrophobicContact CD1-CB 4.05Å
71	Q	95	Very high	94.8	Very high	62 Å²	62	67.4 Å²	67.4	29%	0.29	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	130.9	-177.1	-169.8	170.7	35.1	0	0	108.6	G73 Q74 S108 S110 A111	Q71-G73 PolarHBondContact O-N 2.8Å; Q71-G73 VanDerWaalsContact O-N 3.09Å; Q71-Q74 PolarHBondContact N-O 2.9Å; Q71-Q74 WeakPolarHBondContact O-CB 3.21Å; Q71-Q74 PolarHBondContact O-N 3.41Å; Q71-S108 PolarHBondContact NE2-O 2.79Å; Q71-S108 PolarHBondContact OE1-O 3.27Å; Q71-S110 PolarHBondContact NE2-O 3.24Å; Q71-A111 HydrophobicContact CB-CB 4.09Å; Q71-A111 HydrophobicContact CG-CB 4.38Å
72	D	92	Very high	95	Very high	166 Å²	166	65.3 Å²	65.3	89%	0.888	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	35.3	179.3	-55.9	-36.5	0	0	0	114.6	Q74	D72-Q74 PolarHBondContact O-N 3.37Å
73	G	90.4	Very high	95.3	Very high	77 Å²	77	65.8 Å²	65.8	79%	0.794	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-5.5	-177.6	0	0	0	0	0	115	Q71	Q71-G73 PolarHBondContact O-N 2.8Å; Q71-G73 VanDerWaalsContact O-N 3.09Å
74	Q	94.3	Very high	95.4	Very high	136 Å²	136	66.6 Å²	66.6	64%	0.636	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	135	173.7	-169.1	175	-5.1	0	0	110.6	I70 Q71 D72 T76	I70-Q74 WeakPolarHBondContact CA-O 3.33Å; Q71-Q74 PolarHBondContact N-O 2.9Å; Q71-Q74 WeakPolarHBondContact O-CB 3.21Å; Q71-Q74 PolarHBondContact O-N 3.41Å; D72-Q74 PolarHBondContact O-N 3.37Å; Q74-T76 HydrophobicContact CG-CG2 4.27Å
75	T	96.6	Very high	95.5	Very high	72 Å²	72	63.3 Å²	63.3	44%	0.442	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.2	174.3	-57.3	0	0	0	0	109.6	K68 K69 I70	K68-T75 HydrophobicContact CB-CG2 3.84Å; K68-T75 HydrophobicContact CD-CG2 4.25Å; K68-T75 HydrophobicContact CG-CG2 4.21Å; K69-T75 CarbonylContact O-C 3.52Å; K69-T75 WeakPolarHBondContact O-CA 3.4Å; I70-T75 HydrophobicContact CG1-CG2 4.14Å
76	T	96.4	Very high	95.4	Very high	49 Å²	49	64.9 Å²	64.9	30%	0.301	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.9	178	56.3	0	0	0	0	110.6	K68 K69 Q74	K68-T76 CarbonylContact C-O 3.48Å; K68-T76 VanDerWaalsContact CA-O 3.22Å; K68-T76 WeakPolarHBondContact CA-O 3.15Å; K69-T76 PolarHBondContact N-O 2.93Å; K69-T76 PolarHBondContact O-N 3.41Å; Q74-T76 HydrophobicContact CG-CG2 4.27Å
77	Y	97	Very high	95.2	Very high	96 Å²	96	68.2 Å²	68.2	38%	0.376	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	129.6	175.7	-74.7	-78.9	0	0	0	110.5	K68 F80 Q85	K68-Y77 HydrophobicContact CD-CE1 4.21Å; K68-Y77 HydrophobicContact CG-CD1 3.92Å; K68-Y77 HydrophobicContact CG-CE1 3.99Å; Y77-F80 HydrophobicContact CD1-CB 3.67Å; Y77-F80 HydrophobicContact CD1-CD2 4.11Å; Y77-F80 HydrophobicContact CD1-CG 4.07Å; Y77-F80 HydrophobicContact CE1-CB 4.21Å; Y77-F80 AromaticContact CE1-CD2 3.75Å; Y77-F80 HydrophobicContact CE1-CD2 3.75Å; Y77-F80 HydrophobicContact CE1-CE2 4.45Å; Y77-F80 HydrophobicContact CE1-CG 4.12Å; Y77-F80 HydrophobicContact CG-CB 4.07Å; Y77-Q85 CarbonylContact O-C 3.53Å
78	V	97.4	Very high	95.1	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.006	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-40.9	170.3	177.6	0	0	0	0	110.1	W67 K69 I84 Q85 L88 L100 Y113	W67-V78 HydrophobicContact CB-CB 4.08Å; W67-V78 PolarHBondContact O-N 2.73Å; K69-V78 HydrophobicContact CB-CG2 3.61Å; V78-I84 CarbonylContact O-C 3.46Å; V78-I84 VanDerWaalsContact O-CA 3.28Å; V78-I84 WeakPolarHBondContact O-CA 3.43Å; V78-Q85 PolarHBondContact O-N 2.94Å; V78-L88 HydrophobicContact CB-CD1 4.5Å; V78-L88 HydrophobicContact CG1-CB 4.35Å; V78-L88 HydrophobicContact CG1-CD1 3.67Å; V78-L88 HydrophobicContact CG2-CD1 3.99Å; V78-L100 HydrophobicContact CB-CD1 4.42Å; V78-L100 HydrophobicContact CG1-CD1 3.67Å; V78-Y113 HydrophobicContact CG2-CD1 4.36Å; V78-Y113 HydrophobicContact CG2-CE1 4.18Å
79	Y	97.4	Very high	95	Very high	24 Å²	24	71.5 Å²	71.5	9%	0.094	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	122.8	175.2	-179.5	-102.6	0	0	0	109.4	I65 E66 W67 N82 K83 I84 V94	I65-Y79 HydrophobicContact CB-CE1 4.17Å; I65-Y79 HydrophobicContact CG2-CD1 4.24Å; I65-Y79 HydrophobicContact CG2-CE1 4.26Å; I65-Y79 WeakPolarHBondContact O-CD1 3.46Å; E66-Y79 WeakPolarHBondContact CA-O 3.44Å; W67-Y79 PolarHBondContact N-O 2.79Å; W67-Y79 PolarHBondContact O-N 3.08Å; Y79-N82 WeakPolarHBondContact OH-CA 3.47Å; Y79-N82 PolarHBondContact OH-OD1 2.51Å; Y79-K83 WeakPolarHBondContact CA-O 3.38Å; Y79-I84 HydrophobicContact CD2-CD1 3.69Å; Y79-I84 HydrophobicContact CD2-CG1 4.33Å; Y79-I84 HydrophobicContact CG-CD1 4.4Å; Y79-V94 HydrophobicContact CD2-CG2 3.65Å; Y79-V94 HydrophobicContact CE1-CG2 4.4Å; Y79-V94 HydrophobicContact CE2-CG2 3.42Å; Y79-V94 VanDerWaalsContact CE2-CG2 3.42Å; Y79-V94 HydrophobicContact CG-CG2 4.2Å
80	F	95.6	Very high	94.9	Very high	63 Å²	63	75 Å²	75	28%	0.276	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	142.5	176.4	179.4	-99.8	0	0	0	109.3	E66 Y77 N82 K83 Q85	E66-F80 HydrophobicContact CG-CD2 3.86Å; E66-F80 HydrophobicContact CG-CE2 4.25Å; Y77-F80 HydrophobicContact CD1-CB 3.67Å; Y77-F80 HydrophobicContact CD1-CD2 4.11Å; Y77-F80 HydrophobicContact CD1-CG 4.07Å; Y77-F80 HydrophobicContact CE1-CB 4.21Å; Y77-F80 AromaticContact CE1-CD2 3.75Å; Y77-F80 HydrophobicContact CE1-CD2 3.75Å; Y77-F80 HydrophobicContact CE1-CE2 4.45Å; Y77-F80 HydrophobicContact CE1-CG 4.12Å; Y77-F80 HydrophobicContact CG-CB 4.07Å; F80-N82 VanDerWaalsContact C-N 3.32Å; F80-N82 PolarHBondContact O-N 2.9Å; F80-K83 PolarHBondContact N-O 2.96Å; F80-K83 PolarHBondContact O-N 3.45Å; F80-K83 VanDerWaalsContact O-N 3.12Å; F80-K83 VanDerWaalsContact O-O 3.11Å; F80-Q85 PolarHBondContact O-NE2 2.99Å
81	D	92.1	Very high	94.8	Very high	127 Å²	127	75.7 Å²	75.7	68%	0.679	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	49.1	-179.6	-164.8	30.9	0	0	0	112.6	K83	D81-K83 PolarHBondContact O-N 3.35Å
82	N	91.1	Very high	94.9	Very high	121 Å²	121	73.5 Å²	73.5	65%	0.647	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	24	-178.8	-63.8	-32.5	0	0	0	115.6	Y79 F80	Y79-N82 WeakPolarHBondContact OH-CA 3.47Å; Y79-N82 PolarHBondContact OH-OD1 2.51Å; F80-N82 VanDerWaalsContact C-N 3.32Å; F80-N82 PolarHBondContact O-N 2.9Å
83	K	95.1	Very high	95	Very high	143 Å²	143	68.4 Å²	68.4	62%	0.622	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.7	-177.6	-168.3	179.2	177	-178.6	0	111.4	Y79 F80 D81	Y79-K83 WeakPolarHBondContact CA-O 3.38Å; F80-K83 PolarHBondContact N-O 2.96Å; F80-K83 PolarHBondContact O-N 3.45Å; F80-K83 VanDerWaalsContact O-N 3.12Å; F80-K83 VanDerWaalsContact O-O 3.11Å; D81-K83 PolarHBondContact O-N 3.35Å
84	I	96.7	Very high	95.2	Very high	33 Å²	33	67 Å²	67	17%	0.169	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	135.2	169.2	-57	-71.2	0	0	0	109.2	V78 Y79 V89 T92 V94 L100	V78-I84 CarbonylContact O-C 3.46Å; V78-I84 VanDerWaalsContact O-CA 3.28Å; V78-I84 WeakPolarHBondContact O-CA 3.43Å; Y79-I84 HydrophobicContact CD2-CD1 3.69Å; Y79-I84 HydrophobicContact CD2-CG1 4.33Å; Y79-I84 HydrophobicContact CG-CD1 4.4Å; I84-V89 HydrophobicContact CG2-CG2 4.13Å; I84-T92 HydrophobicContact CD1-CG2 4.11Å; I84-V94 HydrophobicContact CD1-CG2 4.3Å; I84-L100 HydrophobicContact CD1-CD2 4.3Å
85	Q	95.1	Very high	95.1	Very high	66 Å²	66	64.5 Å²	64.5	31%	0.308	36%	0.357	S	S	.	.			trans	-135	169.7	-175.5	-54.5	-174	29.4	0	0	110.7	Y77 V78 F80	Y77-Q85 CarbonylContact O-C 3.53Å; V78-Q85 PolarHBondContact O-N 2.94Å; F80-Q85 PolarHBondContact O-NE2 2.99Å
86	G	93.1	Very high	94.5	Very high	52 Å²	52	64.4 Å²	64.4	54%	0.536	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	79.3	-153.2	177	0	0	0	0	0	114.9	L88 V89	G86-L88 VanDerWaalsContact C-N 3.26Å; G86-L88 PolarHBondContact O-N 2.82Å; G86-V89 WeakPolarHBondContact O-CG2 3.5Å
87	D	93.7	Very high	93.9	Very high	77 Å²	77	70.4 Å²	70.4	41%	0.412	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-75.9	-9.1	-177.5	59.3	-33.7	0	0	0	114.2	K69	K69-D87 IonicContact NZ-OD2 2.83Å; K69-D87 PolarHBondContact NZ-OD2 2.85Å
88	L	95.4	Very high	93.8	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-97.5	-1.5	-177.6	-67.9	-177.7	0	0	0	113.8	V78 G86 G90 R91 T92 I102 D109 Y113	V78-L88 HydrophobicContact CB-CD1 4.5Å; V78-L88 HydrophobicContact CG1-CB 4.35Å; V78-L88 HydrophobicContact CG1-CD1 3.67Å; V78-L88 HydrophobicContact CG2-CD1 3.99Å; G86-L88 VanDerWaalsContact C-N 3.26Å; G86-L88 PolarHBondContact O-N 2.82Å; L88-G90 PolarHBondContact O-N 2.04Å; L88-R91 PolarHBondContact O-N 2.81Å; L88-T92 WeakPolarHBondContact CB-OG1 3.47Å; L88-T92 PolarHBondContact O-N 3.07Å; L88-T92 PolarHBondContact O-OG1 2.78Å; L88-I102 HydrophobicContact CD1-CD1 4.09Å; L88-I102 HydrophobicContact CD2-CG2 4.1Å; L88-D109 WeakPolarHBondContact CD2-OD1 3.38Å; L88-Y113 HydrophobicContact CD1-CE1 3.9Å
89	V	95.9	Very high	93.8	Very high	89 Å²	89	66.5 Å²	66.5	54%	0.539	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	127.5	176.9	177.8	0	0	0	0	110.6	I84 G86 R91	I84-V89 HydrophobicContact CG2-CG2 4.13Å; G86-V89 WeakPolarHBondContact O-CG2 3.5Å; V89-R91 VanDerWaalsContact C-N 3.26Å; V89-R91 PolarHBondContact O-N 3.4Å
90	G	94.8	Very high	93.8	Very high	79 Å²	79	65.4 Å²	65.4	81%	0.814	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-7.8	-179.1	0	0	0	0	0	114.9	L88	L88-G90 PolarHBondContact O-N 2.04Å
91	R	96.1	Very high	93.9	Very high	57 Å²	57	65.2 Å²	65.2	22%	0.215	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	4.4	173.1	-65.4	-167.3	-61.7	129.5	3.3	113.1	L88 V89 I102 W103 N104 D109	L88-R91 PolarHBondContact O-N 2.81Å; V89-R91 VanDerWaalsContact C-N 3.26Å; V89-R91 PolarHBondContact O-N 3.4Å; R91-I102 CarbonylContact O-C 3.54Å; R91-I102 WeakPolarHBondContact O-CA 3.39Å; R91-W103 PolarHBondContact O-N 2.75Å; R91-N104 PolarHBondContact NH1-O 3.02Å; R91-D109 IonicContact CZ-OD2 2.79Å; R91-D109 IonicContact NH1-OD1 3.46Å; R91-D109 IonicContact NH1-OD2 2.66Å; R91-D109 PolarHBondContact NH1-OD2 3.4Å; R91-D109 IonicContact NH2-OD1 2.81Å; R91-D109 PolarHBondContact NH2-OD1 3.09Å; R91-D109 VanDerWaalsContact NH2-OD1 3.12Å; R91-D109 IonicContact NH2-OD2 3.11Å; R91-D109 PolarHBondContact NH2-OD2 2.87Å
92	T	96.8	Very high	94.1	Very high	15 Å²	15	59.1 Å²	59.1	9%	0.092	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.4	-176.8	-60	0	0	0	0	111.5	I84 L88 L100 R101 I102	I84-T92 HydrophobicContact CD1-CG2 4.11Å; L88-T92 WeakPolarHBondContact CB-OG1 3.47Å; L88-T92 PolarHBondContact O-N 3.07Å; L88-T92 PolarHBondContact O-OG1 2.78Å; T92-L100 HydrophobicContact CG2-CB 4.28Å; T92-L100 HydrophobicContact CG2-CD1 4.43Å; T92-L100 HydrophobicContact CG2-CD2 4.02Å; T92-L100 HydrophobicContact CG2-CG 4.48Å; T92-R101 VanDerWaalsContact CA-O 3.25Å; T92-R101 WeakPolarHBondContact CA-O 3.38Å; T92-R101 WeakPolarHBondContact CG2-O 3.29Å; T92-I102 HydrophobicContact CG2-CG1 4.15Å
93	D	94.8	Very high	94.4	Very high	60 Å²	60	58.8 Å²	58.8	32%	0.321	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	150.5	173.5	61	-48.5	0	0	0	110.8	F95 R101 W103	D93-F95 PolarHBondContact O-N 2.86Å; D93-R101 PolarHBondContact N-O 2.75Å; D93-R101 PolarHBondContact O-N 3.34Å; D93-R101 WeakPolarHBondContact OD1-CB 3.48Å; D93-W103 PolarHBondContact OD1-NE1 2.91Å
94	V	94.3	Very high	94.5	Very high	48 Å²	48	56.8 Å²	56.8	29%	0.291	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	118.5	170.1	-178.2	0	0	0	0	107.4	Y79 I84 S99 L100	Y79-V94 HydrophobicContact CD2-CG2 3.65Å; Y79-V94 HydrophobicContact CE1-CG2 4.4Å; Y79-V94 HydrophobicContact CE2-CG2 3.42Å; Y79-V94 VanDerWaalsContact CE2-CG2 3.42Å; Y79-V94 HydrophobicContact CG-CG2 4.2Å; I84-V94 HydrophobicContact CD1-CG2 4.3Å; V94-S99 CarbonylContact C-O 3.58Å; V94-S99 WeakPolarHBondContact CA-O 3.45Å; V94-L100 HydrophobicContact CG2-CD2 4.02Å
95	F	90.8	Very high	94.6	Very high	82 Å²	82	55.2 Å²	55.2	36%	0.36	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.2	178.5	-174	-105.6	0	0	0	110.4	E50 D93 K97 S99 R101	E50-F95 WeakPolarHBondContact OE2-CD1 3.4Å; D93-F95 PolarHBondContact O-N 2.86Å; F95-K97 PolarHBondContact O-N 2.68Å; F95-S99 PolarHBondContact N-O 3.02Å; F95-S99 PolarHBondContact O-N 3.48Å; F95-R101 HydrophobicContact CB-CB 4.1Å
96	G	84.5	Confident	94.7	Very high	70 Å²	70	53.6 Å²	53.6	72%	0.722	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	-107.1	-173.9	0	0	0	0	0	111.7
97	K	85.2	Confident	94.8	Very high	175 Å²	175	56.1 Å²	56.1	76%	0.761	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	-30	178.3	-68.5	-171.9	176.8	-173.4	0	113.8	I65 F95	I65-K97 WeakPolarHBondContact CD1-O 3.16Å; F95-K97 PolarHBondContact O-N 2.68Å
98	T	94.1	Very high	94.8	Very high	9 Å²	9	55.5 Å²	55.5	6%	0.055	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.6	-21.2	-165.8	43.4	0	0	0	0	114	C53 I55 I65 W67	C53-T98 CarbonylContact O-C 3.56Å; C53-T98 WeakPolarHBondContact O-CB 3.02Å; C53-T98 PolarHBondContact O-OG1 2.84Å; I55-T98 HydrophobicContact CD1-CG2 3.5Å; I55-T98 HydrophobicContact CG1-CG2 3.77Å; I65-T98 HydrophobicContact CD1-CG2 3.63Å; I65-T98 HydrophobicContact CG1-CG2 3.72Å; W67-T98 WeakPolarHBondContact CZ2-O 3.4Å; W67-T98 PolarHBondContact NE1-O 2.78Å
99	S	96.8	Very high	94.9	Very high	7 Å²	7	55.5 Å²	55.5	5%	0.049	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	153.6	178.3	-62.1	0	0	0	0	111.1	L51 C53 V94 F95	L51-S99 WeakPolarHBondContact O-CA 3.5Å; L51-S99 WeakPolarHBondContact O-CB 3.38Å; C53-S99 PolarHBondContact N-OG 2.68Å; C53-S99 PolarHBondContact O-OG 3.24Å; V94-S99 CarbonylContact C-O 3.58Å; V94-S99 WeakPolarHBondContact CA-O 3.45Å; F95-S99 PolarHBondContact N-O 3.02Å; F95-S99 PolarHBondContact O-N 3.48Å
100	L	97.1	Very high	95	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	140.5	170.3	-68.5	-179	0	0	0	110.4	E50 L51 W67 V78 I84 T92 V94	E50-L100 CarbonylContact C-O 3.54Å; E50-L100 WeakPolarHBondContact CA-O 3.45Å; L51-L100 HydrophobicContact CB-CB 4.36Å; L51-L100 PolarHBondContact N-O 2.8Å; L51-L100 PolarHBondContact O-N 3.41Å; L51-L100 VanDerWaalsContact O-N 3.08Å; W67-L100 HydrophobicContact CB-CD1 3.67Å; W67-L100 HydrophobicContact CB-CG 4.49Å; W67-L100 HydrophobicContact CD2-CD1 3.44Å; W67-L100 VanDerWaalsContact CD2-CD1 3.44Å; W67-L100 HydrophobicContact CD2-CG 3.73Å; W67-L100 HydrophobicContact CE3-CD1 3.81Å; W67-L100 HydrophobicContact CE3-CG 4.38Å; W67-L100 HydrophobicContact CG-CD1 3.39Å; W67-L100 HydrophobicContact CG-CD2 4.36Å; W67-L100 HydrophobicContact CG-CG 3.77Å; W67-L100 HydrophobicContact CZ2-CG 4.16Å; V78-L100 HydrophobicContact CB-CD1 4.42Å; V78-L100 HydrophobicContact CG1-CD1 3.67Å; I84-L100 HydrophobicContact CD1-CD2 4.3Å; T92-L100 HydrophobicContact CG2-CB 4.28Å; T92-L100 HydrophobicContact CG2-CD1 4.43Å; T92-L100 HydrophobicContact CG2-CD2 4.02Å; T92-L100 HydrophobicContact CG2-CG 4.48Å; V94-L100 HydrophobicContact CG2-CD2 4.02Å
101	R	97.4	Very high	95.1	Very high	59 Å²	59	49.6 Å²	49.6	22%	0.223	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.6	165	179.6	168.3	-68.9	166	2.7	109	V49 E50 T92 D93 F95 W103	V49-R101 WeakPolarHBondContact O-CA 3.04Å; E50-R101 IonicContact OE2-CZ 3.35Å; E50-R101 IonicContact OE2-NE 3.37Å; E50-R101 IonicContact OE2-NH2 3.58Å; E50-R101 PolarHBondContact OE2-NH2 3.16Å; T92-R101 VanDerWaalsContact CA-O 3.25Å; T92-R101 WeakPolarHBondContact CA-O 3.38Å; T92-R101 WeakPolarHBondContact CG2-O 3.29Å; D93-R101 PolarHBondContact N-O 2.75Å; D93-R101 PolarHBondContact O-N 3.34Å; D93-R101 WeakPolarHBondContact OD1-CB 3.48Å; F95-R101 HydrophobicContact CB-CB 4.1Å; R101-W103 HydrophobicContact CG-CZ2 4.05Å
102	I	97.9	Very high	95.3	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.9	-180	-50.5	175.6	0	0	0	107.7	S48 V49 L51 L88 R91 T92 V105 Y113 L133	S48-I102 CarbonylContact C-O 3.56Å; S48-I102 WeakPolarHBondContact CA-O 3.25Å; S48-I102 WeakPolarHBondContact CB-O 3.43Å; V49-I102 HydrophobicContact CG1-CB 4.12Å; V49-I102 PolarHBondContact N-O 2.74Å; V49-I102 PolarHBondContact O-N 2.83Å; L51-I102 HydrophobicContact CD1-CD1 3.83Å; L51-I102 HydrophobicContact CG-CD1 4.31Å; L88-I102 HydrophobicContact CD1-CD1 4.09Å; L88-I102 HydrophobicContact CD2-CG2 4.1Å; R91-I102 CarbonylContact O-C 3.54Å; R91-I102 WeakPolarHBondContact O-CA 3.39Å; T92-I102 HydrophobicContact CG2-CG1 4.15Å; I102-V105 HydrophobicContact CB-CG1 4.2Å; I102-V105 HydrophobicContact CG2-CG1 3.9Å; I102-Y113 HydrophobicContact CD1-CE1 4.3Å; I102-L133 HydrophobicContact CD1-CD2 4.38Å
103	W	97.8	Very high	95.3	Very high	113 Å²	113	49.3 Å²	49.3	43%	0.428	26%	0.26	S	S	.	.			trans	-104.1	151.8	179.1	-56.4	90.1	0	0	0	110.7	R91 D93 R101 V105	R91-W103 PolarHBondContact O-N 2.75Å; D93-W103 PolarHBondContact OD1-NE1 2.91Å; R101-W103 HydrophobicContact CG-CZ2 4.05Å; W103-V105 VanDerWaalsContact C-N 3.31Å; W103-V105 PolarHBondContact O-N 2.97Å
104	N	97.1	Very high	95.5	Very high	101 Å²	101	49.5 Å²	49.5	54%	0.54	26%	0.256	S	S	.	.	S	Bend	trans	48.8	54.5	178.5	-61.7	-26.5	0	0	0	111	E47 R91	E47-N104 PolarHBondContact O-N 3.21Å; E47-N104 VanDerWaalsContact O-N 3.16Å; R91-N104 PolarHBondContact NH1-O 3.02Å
105	V	97.6	Very high	95.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.			trans	-59.8	144.1	-178.3	-62.5	0	0	0	0	110.8	V43 H44 F46 E47 V49 I102 W103 D109 V135	V43-V105 HydrophobicContact CG1-CG1 4.48Å; V43-V105 HydrophobicContact CG1-CG2 3.83Å; V43-V105 HydrophobicContact CG2-CG2 4.08Å; H44-V105 WeakPolarHBondContact O-CG2 3.48Å; F46-V105 WeakPolarHBondContact CA-O 3.49Å; F46-V105 PolarHBondContact N-O 3.3Å; E47-V105 WeakPolarHBondContact O-CG2 3.43Å; E47-V105 PolarHBondContact O-N 3.36Å; V49-V105 HydrophobicContact CB-CG1 4.46Å; V49-V105 HydrophobicContact CG1-CG1 3.74Å; I102-V105 HydrophobicContact CB-CG1 4.2Å; I102-V105 HydrophobicContact CG2-CG1 3.9Å; W103-V105 VanDerWaalsContact C-N 3.31Å; W103-V105 PolarHBondContact O-N 2.97Å; V105-D109 WeakPolarHBondContact CA-OD2 3.37Å; V105-V135 HydrophobicContact CB-CG2 4.27Å; V105-V135 HydrophobicContact CG2-CG1 4.03Å; V105-V135 HydrophobicContact CG2-CG2 4.38Å
106	T	96.9	Very high	95.9	Very high	32 Å²	32	44.7 Å²	44.7	20%	0.196	23%	0.231	C	C	.	.			trans	-120.8	159.9	179.2	60.9	0	0	0	0	109.3	S108 D109	T106-S108 PolarHBondContact O-N 3.08Å; T106-S108 VanDerWaalsContact O-N 3.08Å; T106-S108 PolarHBondContact OG1-OG 2.92Å; T106-D109 PolarHBondContact N-OD2 3.03Å; T106-D109 VanDerWaalsContact O-CB 3.29Å; T106-D109 WeakPolarHBondContact O-CB 3.44Å; T106-D109 PolarHBondContact O-N 2.89Å; T106-D109 VanDerWaalsContact OG1-CG 3.24Å; T106-D109 PolarHBondContact OG1-OD1 3.06Å; T106-D109 PolarHBondContact OG1-OD2 2.81Å
107	R	95.4	Very high	96.5	Very high	106 Å²	106	41.3 Å²	41.3	40%	0.4	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-53.4	-31.4	176.6	67.2	-174.4	69.1	-179.3	2.5	114.5	E45 D109 S110 V137 E164	E45-R107 PolarHBondContact OE1-N 3.04Å; E45-R107 IonicContact OE1-NE 3.62Å; E45-R107 PolarHBondContact OE1-NE 2.79Å; E45-R107 IonicContact OE2-NH2 3.78Å; R107-D109 PolarHBondContact O-N 2.86Å; R107-S110 WeakPolarHBondContact O-CB 3.33Å; R107-S110 PolarHBondContact O-N 2.87Å; R107-S110 PolarHBondContact O-OG 3.34Å; R107-V137 HydrophobicContact CB-CG2 3.89Å; R107-E164 IonicContact CZ-OE2 2.77Å; R107-E164 IonicContact NH1-OE2 3.95Å; R107-E164 PolarHBondContact NH1-OE2 2.84Å; R107-E164 IonicContact NH2-OE2 3.86Å
108	S	95.1	Very high	96.9	Very high	63 Å²	63	33.5 Å²	33.5	44%	0.441	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-70.9	-14.3	176.7	47.8	0	0	0	0	113.9	K69 Q71 T106 S110	K69-S108 PolarHBondContact NZ-O 3.4Å; Q71-S108 PolarHBondContact NE2-O 2.79Å; Q71-S108 PolarHBondContact OE1-O 3.27Å; T106-S108 PolarHBondContact O-N 3.08Å; T106-S108 VanDerWaalsContact O-N 3.08Å; T106-S108 PolarHBondContact OG1-OG 2.92Å; S108-S110 VanDerWaalsContact C-N 3.25Å
109	D	97.1	Very high	96.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-78.9	-12.5	175.4	-56.9	-34.4	0	0	0	111.4	L88 R91 V105 T106 R107 A111 Y113 V135	L88-D109 WeakPolarHBondContact CD2-OD1 3.38Å; R91-D109 IonicContact CZ-OD2 2.79Å; R91-D109 IonicContact NH1-OD1 3.46Å; R91-D109 IonicContact NH1-OD2 2.66Å; R91-D109 PolarHBondContact NH1-OD2 3.4Å; R91-D109 IonicContact NH2-OD1 2.81Å; R91-D109 PolarHBondContact NH2-OD1 3.09Å; R91-D109 VanDerWaalsContact NH2-OD1 3.12Å; R91-D109 IonicContact NH2-OD2 3.11Å; R91-D109 PolarHBondContact NH2-OD2 2.87Å; V105-D109 WeakPolarHBondContact CA-OD2 3.37Å; T106-D109 PolarHBondContact N-OD2 3.03Å; T106-D109 VanDerWaalsContact O-CB 3.29Å; T106-D109 WeakPolarHBondContact O-CB 3.44Å; T106-D109 PolarHBondContact O-N 2.89Å; T106-D109 VanDerWaalsContact OG1-CG 3.24Å; T106-D109 PolarHBondContact OG1-OD1 3.06Å; T106-D109 PolarHBondContact OG1-OD2 2.81Å; R107-D109 PolarHBondContact O-N 2.86Å; D109-A111 PolarHBondContact O-N 3.18Å; D109-A111 VanDerWaalsContact O-N 3.12Å; D109-Y113 VanDerWaalsContact O-CE2 3.26Å; D109-Y113 WeakPolarHBondContact O-CE2 3.49Å; D109-Y113 PolarHBondContact O-OH 3.28Å; D109-V135 HydrophobicContact CB-CG2 4.47Å
110	S	97.4	Very high	96.6	Very high	34 Å²	34	38.8 Å²	38.8	24%	0.238	19%	0.19	C	C	.	.			trans	-63.4	109.8	172.2	-58.5	0	0	0	0	110.6	Q71 R107 S108 L133 V135	Q71-S110 PolarHBondContact NE2-O 3.24Å; R107-S110 WeakPolarHBondContact O-CB 3.33Å; R107-S110 PolarHBondContact O-N 2.87Å; R107-S110 PolarHBondContact O-OG 3.34Å; S108-S110 VanDerWaalsContact C-N 3.25Å; S110-L133 WeakPolarHBondContact CA-O 3.38Å; S110-V135 VanDerWaalsContact OG-CB 3.31Å; S110-V135 WeakPolarHBondContact OG-CB 3.46Å; S110-V135 PolarHBondContact OG-N 3.28Å
111	A	97.8	Very high	96.1	Very high	11 Å²	11	44.6 Å²	44.6	9%	0.091	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	171.9	-173.4	0	0	0	0	0	110.4	K69 Q71 D109 Y113 L133	K69-A111 HydrophobicContact CD-CB 4.37Å; K69-A111 HydrophobicContact CG-CB 3.76Å; Q71-A111 HydrophobicContact CB-CB 4.09Å; Q71-A111 HydrophobicContact CG-CB 4.38Å; D109-A111 PolarHBondContact O-N 3.18Å; D109-A111 VanDerWaalsContact O-N 3.12Å; A111-Y113 HydrophobicContact CB-CD2 4.44Å; A111-Y113 HydrophobicContact CB-CE2 3.87Å; A111-Y113 WeakPolarHBondContact O-CD2 3.48Å; A111-L133 PolarHBondContact N-O 3.24Å; A111-L133 PolarHBondContact O-N 2.98Å
112	I	98.4	Very high	95.5	Very high	66 Å²	66	42 Å²	42	34%	0.338	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	118.4	168.7	-64.9	175.4	0	0	0	108.1	I70 T130 I131 E132	I70-I112 WeakPolarHBondContact CA-O 3.43Å; I70-I112 HydrophobicContact CB-CB 4.24Å; I70-I112 WeakPolarHBondContact CB-O 3.2Å; I70-I112 HydrophobicContact CD1-CG2 4.36Å; I70-I112 PolarHBondContact N-O 2.88Å; I70-I112 PolarHBondContact O-N 2.78Å; I70-I112 VanDerWaalsContact O-N 3.07Å; I112-T130 HydrophobicContact CG2-CG2 3.13Å; I112-I131 CarbonylContact C-O 3.6Å; I112-I131 WeakPolarHBondContact CA-O 3.34Å; I112-E132 HydrophobicContact CG1-CG 4.45Å
113	Y	98.2	Very high	94.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.7	174.6	-67.4	-97.1	0	0	0	109.7	L51 K68 K69 V78 L88 I102 D109 A111 T130 I131 L133	L51-Y113 HydrophobicContact CD1-CD1 3.73Å; L51-Y113 HydrophobicContact CD1-CD2 3.79Å; L51-Y113 HydrophobicContact CD1-CE1 4.24Å; L51-Y113 HydrophobicContact CD1-CE2 4.3Å; L51-Y113 HydrophobicContact CD1-CG 3.48Å; L51-Y113 VanDerWaalsContact CD1-CG 3.48Å; K68-Y113 CarbonylContact O-C 3.6Å; K68-Y113 WeakPolarHBondContact O-CA 3.45Å; K69-Y113 HydrophobicContact CB-CD1 4.22Å; K69-Y113 HydrophobicContact CB-CE1 3.94Å; K69-Y113 HydrophobicContact CD-CE1 4.22Å; K69-Y113 WeakPolarHBondContact CE-OH 3.46Å; K69-Y113 HydrophobicContact CG-CD1 4.41Å; K69-Y113 HydrophobicContact CG-CE1 3.84Å; V78-Y113 HydrophobicContact CG2-CD1 4.36Å; V78-Y113 HydrophobicContact CG2-CE1 4.18Å; L88-Y113 HydrophobicContact CD1-CE1 3.9Å; I102-Y113 HydrophobicContact CD1-CE1 4.3Å; D109-Y113 VanDerWaalsContact O-CE2 3.26Å; D109-Y113 WeakPolarHBondContact O-CE2 3.49Å; D109-Y113 PolarHBondContact O-OH 3.28Å; A111-Y113 HydrophobicContact CB-CD2 4.44Å; A111-Y113 HydrophobicContact CB-CE2 3.87Å; A111-Y113 WeakPolarHBondContact O-CD2 3.48Å; Y113-T130 CarbonylContact O-C 3.44Å; Y113-T130 WeakPolarHBondContact O-CA 3.16Å; Y113-I131 PolarHBondContact N-O 2.88Å; Y113-I131 PolarHBondContact O-N 3.12Å; Y113-L133 HydrophobicContact CD2-CB 3.93Å; Y113-L133 HydrophobicContact CE2-CB 3.8Å; Y113-L133 HydrophobicContact CE2-CD2 3.81Å; Y113-L133 HydrophobicContact CE2-CG 4.43Å
114	R	98.2	Very high	94.3	Very high	63 Å²	63	49.7 Å²	49.7	24%	0.238	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.4	177.2	179.8	166.1	55	167.7	-4.1	110	W67 K68 I70 E128 I129	W67-R114 WeakPolarHBondContact CA-O 2.94Å; K68-R114 PolarHBondContact N-O 2.82Å; K68-R114 PolarHBondContact O-N 3.36Å; I70-R114 HydrophobicContact CD1-CB 4.05Å; R114-E128 WeakPolarHBondContact CD-OE2 3.37Å; R114-E128 IonicContact NH1-OE2 2.83Å; R114-E128 PolarHBondContact NH1-OE2 2.83Å; R114-I129 WeakPolarHBondContact CA-O 3.46Å
115	C	97.9	Very high	94	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.6	167	-179.2	0	0	0	0	108.3	C53 W67 E128 I129	C53-C115 HydrophobicContact CB-CB 3.59Å; C53-C115 WeakPolarHBondContact CB-SG 3.48Å; C53-C115 WeakPolarHBondContact SG-CB 3.21Å; C53-C115 CovalentContact SG-SG 2.04Å; C53-C115 PolarHBondContact SG-SG 3.31Å; W67-C115 HydrophobicContact CD2-CB 3.97Å; W67-C115 HydrophobicContact CE3-CB 4.03Å; W67-C115 HydrophobicContact CH2-CB 3.78Å; W67-C115 HydrophobicContact CZ2-CB 3.69Å; W67-C115 HydrophobicContact CZ3-CB 3.93Å; C115-E128 CarbonylContact O-C 3.56Å; C115-E128 WeakPolarHBondContact O-CA 3.49Å; C115-E128 WeakPolarHBondContact O-CB 3.36Å; C115-I129 PolarHBondContact N-O 2.75Å; C115-I129 PolarHBondContact O-N 3.28Å
116	E	96.9	Very high	93.8	Very high	29 Å²	29	53.7 Å²	53.7	14%	0.136	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.7	176.4	-174.3	-177.3	152	0	0	108.1	E66 K68 I126	E66-E116 HydrophobicContact CB-CB 4.42Å; E66-E116 PolarHBondContact N-O 2.8Å; E66-E116 PolarHBondContact O-N 3.37Å; K68-E116 IonicContact NZ-OE2 2.71Å; K68-E116 PolarHBondContact NZ-OE2 2.88Å; E116-I126 HydrophobicContact CG-CG2 3.92Å
117	V	95.8	Very high	93.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124	-179.5	179	0	0	0	0	109.2	V32 L34 I55 P63 R64 I65 I126 D127	V32-V117 HydrophobicContact CG2-CB 4.48Å; V32-V117 HydrophobicContact CG2-CG1 4Å; L34-V117 HydrophobicContact CD1-CB 4.07Å; L34-V117 HydrophobicContact CD1-CG2 3.87Å; L34-V117 HydrophobicContact CD2-CB 3.97Å; L34-V117 HydrophobicContact CD2-CG2 3.67Å; L34-V117 HydrophobicContact CG-CB 4.49Å; L34-V117 HydrophobicContact CG-CG2 4.39Å; I55-V117 HydrophobicContact CD1-CG1 3.92Å; I55-V117 HydrophobicContact CG1-CG1 4.37Å; I55-V117 HydrophobicContact CG1-CG2 4.49Å; P63-V117 HydrophobicContact CB-CG1 3.69Å; P63-V117 HydrophobicContact CG-CG1 4.1Å; R64-V117 WeakPolarHBondContact O-CA 3.37Å; I65-V117 HydrophobicContact CG1-CG2 4.17Å; V117-I126 WeakPolarHBondContact O-CA 3.26Å; V117-D127 PolarHBondContact N-O 3.45Å; V117-D127 PolarHBondContact O-N 3.08Å; V117-D127 VanDerWaalsContact O-N 3.17Å
118	V	94.6	Very high	93.8	Very high	11 Å²	11	52.8 Å²	52.8	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.5	179.9	-173.6	0	0	0	0	110	P63 R64 L120 E125 I126	P63-V118 CarbonylContact C-O 3.43Å; P63-V118 WeakPolarHBondContact CA-O 3.29Å; R64-V118 HydrophobicContact CB-CB 4.29Å; R64-V118 PolarHBondContact N-O 3.42Å; R64-V118 PolarHBondContact O-N 3.35Å; V118-L120 HydrophobicContact CG1-CD2 4.04Å; V118-E125 CarbonylContact C-O 3.56Å; V118-E125 VanDerWaalsContact CA-O 3.25Å; V118-E125 WeakPolarHBondContact CA-O 3.46Å; V118-I126 HydrophobicContact CG1-CG1 4.18Å; V118-I126 HydrophobicContact CG2-CD1 4.41Å; V118-I126 HydrophobicContact CG2-CG1 4.13Å
119	A	93.8	Very high	93.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.239	C	C	.	.			trans	-119	88.4	-176.8	0	0	0	0	0	110.2	V32 T60 P63 N121 D122 E125	V32-A119 HydrophobicContact CB-CB 3.82Å; V32-A119 HydrophobicContact CG1-CB 4.26Å; V32-A119 HydrophobicContact CG2-CB 4.11Å; T60-A119 HydrophobicContact CG2-CB 4.41Å; T60-A119 WeakPolarHBondContact OG1-CA 3.13Å; T60-A119 WeakPolarHBondContact OG1-CB 3.22Å; P63-A119 HydrophobicContact CB-CB 4.17Å; A119-N121 PolarHBondContact O-N 3.38Å; A119-N121 VanDerWaalsContact O-N 3.09Å; A119-D122 HydrophobicContact CB-CB 4.05Å; A119-D122 WeakPolarHBondContact O-CB 3.44Å; A119-D122 PolarHBondContact O-N 3.11Å; A119-E125 PolarHBondContact N-O 3.41Å; A119-E125 WeakPolarHBondContact O-CA 3.34Å
120	L	89.3	Confident	93.9	Very high	126 Å²	126	52.8 Å²	52.8	66%	0.66	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.7	-169.8	-63.2	175.3	0	0	0	115.2	V118	V118-L120 HydrophobicContact CG1-CD2 4.04Å
121	N	86.9	Confident	94	Very high	123 Å²	123	51.1 Å²	51.1	66%	0.658	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-0.2	179.6	-61.7	-30.8	0	0	0	112.9	T60 A119	T60-N121 WeakPolarHBondContact OG1-CB 3.48Å; T60-N121 PolarHBondContact OG1-N 2.9Å; A119-N121 PolarHBondContact O-N 3.38Å; A119-N121 VanDerWaalsContact O-N 3.09Å
122	D	85.4	Confident	94	Very high	5 Å²	5	54.9 Å²	54.9	3%	0.027	26%	0.261	C	S	.	.	S	Bend	trans	-97.9	147.8	-177.6	-63.9	22.1	0	0	0	109.5	V32 S58 Q59 T60 A119 K124 E125	V32-D122 PolarHBondContact N-OD2 3.47Å; S58-D122 WeakPolarHBondContact CA-OD2 3.4Å; S58-D122 WeakPolarHBondContact CB-OD2 3.41Å; S58-D122 PolarHBondContact OG-OD1 3.2Å; S58-D122 PolarHBondContact OG-OD2 2.91Å; Q59-D122 PolarHBondContact N-OD1 3.39Å; Q59-D122 PolarHBondContact N-OD2 2.71Å; T60-D122 PolarHBondContact N-OD1 2.78Å; T60-D122 PolarHBondContact OG1-OD1 2.81Å; A119-D122 HydrophobicContact CB-CB 4.05Å; A119-D122 WeakPolarHBondContact O-CB 3.44Å; A119-D122 PolarHBondContact O-N 3.11Å; D122-K124 VanDerWaalsContact C-N 3.27Å; D122-K124 WeakPolarHBondContact CB-O 3.37Å; D122-K124 PolarHBondContact O-N 3.42Å; D122-E125 WeakPolarHBondContact O-CG 3.06Å
123	R	84.1	Confident	94	Very high	190 Å²	190	51.9 Å²	51.9	72%	0.717	25%	0.245	S	C	*	.	S	Bend	trans	-64.2	-35.5	178.7	-60.6	-177.7	-176	174.6	7.7	112.3	E30	E30-R123 HydrophobicContact CB-CG 3.83Å; E30-R123 VanDerWaalsContact CD-NH2 3.28Å; E30-R123 WeakPolarHBondContact O-CA 3.38Å; E30-R123 WeakPolarHBondContact O-CB 3.28Å; E30-R123 WeakPolarHBondContact O-CG 3.4Å; E30-R123 PolarHBondContact O-N 2.79Å; E30-R123 IonicContact OE1-NH2 2.71Å; E30-R123 PolarHBondContact OE1-NH2 3.18Å; E30-R123 IonicContact OE2-CZ 3.97Å; E30-R123 IonicContact OE2-NE 3.65Å; E30-R123 PolarHBondContact OE2-NE 3.02Å; E30-R123 IonicContact OE2-NH2 3.3Å; E30-R123 PolarHBondContact OE2-NH2 3.18Å
124	K	86.2	Confident	94	Very high	84 Å²	84	54 Å²	54	37%	0.365	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-95.6	103.6	163.1	-178.5	-177.4	170.3	-170.1	0	105.9	A31 V32 D122 I126 D127	A31-K124 HydrophobicContact CB-CB 3.6Å; V32-K124 WeakPolarHBondContact CG1-O 3.42Å; V32-K124 PolarHBondContact N-O 2.97Å; D122-K124 VanDerWaalsContact C-N 3.27Å; D122-K124 WeakPolarHBondContact CB-O 3.37Å; D122-K124 PolarHBondContact O-N 3.42Å; K124-I126 VanDerWaalsContact C-N 3.33Å; K124-I126 WeakPolarHBondContact CE-O 3.34Å; K124-I126 WeakPolarHBondContact CG-O 3.44Å; K124-D127 IonicContact NZ-OD1 3.72Å; K124-D127 PolarHBondContact NZ-OD1 3.44Å; K124-D127 IonicContact NZ-OD2 3.65Å; K124-D127 PolarHBondContact NZ-OD2 3.03Å
125	E	90.2	Very high	94	Very high	102 Å²	102	51 Å²	51	48%	0.477	25%	0.245	S	C	.	.			trans	-75.7	-23.3	-175.9	-65.3	175.4	-163.4	0	0	112.5	V118 A119 D122	V118-E125 CarbonylContact C-O 3.56Å; V118-E125 VanDerWaalsContact CA-O 3.25Å; V118-E125 WeakPolarHBondContact CA-O 3.46Å; A119-E125 PolarHBondContact N-O 3.41Å; A119-E125 WeakPolarHBondContact O-CA 3.34Å; D122-E125 WeakPolarHBondContact O-CG 3.06Å
126	I	93.8	Very high	94	Very high	82 Å²	82	52 Å²	52	42%	0.421	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132.1	-173.1	-52.1	-179.1	0	0	0	110.2	E116 V117 V118 K124	E116-I126 HydrophobicContact CG-CG2 3.92Å; V117-I126 WeakPolarHBondContact O-CA 3.26Å; V118-I126 HydrophobicContact CG1-CG1 4.18Å; V118-I126 HydrophobicContact CG2-CD1 4.41Å; V118-I126 HydrophobicContact CG2-CG1 4.13Å; K124-I126 VanDerWaalsContact C-N 3.33Å; K124-I126 WeakPolarHBondContact CE-O 3.34Å; K124-I126 WeakPolarHBondContact CG-O 3.44Å
127	D	95.5	Very high	94.1	Very high	26 Å²	26	50.9 Å²	50.9	14%	0.139	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.9	165.2	-164.4	27.2	0	0	0	110.3	V32 N33 L34 V117 K124	V32-D127 HydrophobicContact CG1-CB 3.74Å; N33-D127 WeakPolarHBondContact CA-OD2 3.42Å; L34-D127 HydrophobicContact CD1-CB 4.06Å; L34-D127 VanDerWaalsContact CD1-O 3.29Å; L34-D127 WeakPolarHBondContact CD1-O 3.38Å; L34-D127 HydrophobicContact CG-CB 3.93Å; L34-D127 PolarHBondContact N-OD2 3.38Å; V117-D127 PolarHBondContact N-O 3.45Å; V117-D127 PolarHBondContact O-N 3.08Å; V117-D127 VanDerWaalsContact O-N 3.17Å; K124-D127 IonicContact NZ-OD1 3.72Å; K124-D127 PolarHBondContact NZ-OD1 3.44Å; K124-D127 IonicContact NZ-OD2 3.65Å; K124-D127 PolarHBondContact NZ-OD2 3.03Å
128	E	96.8	Very high	94.1	Very high	93 Å²	93	56.6 Å²	56.6	44%	0.435	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	149	-176.9	62.7	171.8	-155.6	0	0	112.8	R114 C115	R114-E128 WeakPolarHBondContact CD-OE2 3.37Å; R114-E128 IonicContact NH1-OE2 2.83Å; R114-E128 PolarHBondContact NH1-OE2 2.83Å; C115-E128 CarbonylContact O-C 3.56Å; C115-E128 WeakPolarHBondContact O-CA 3.49Å; C115-E128 WeakPolarHBondContact O-CB 3.36Å
129	I	97.6	Very high	94.3	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.7	170.5	-68.7	-174.8	0	0	0	109.5	L34 R114 C115 I131	L34-I129 HydrophobicContact CB-CD1 3.51Å; L34-I129 HydrophobicContact CB-CG1 3.69Å; L34-I129 HydrophobicContact CD1-CG1 4.35Å; R114-I129 WeakPolarHBondContact CA-O 3.46Å; C115-I129 PolarHBondContact N-O 2.75Å; C115-I129 PolarHBondContact O-N 3.28Å; I129-I131 HydrophobicContact CG2-CD1 4.36Å; I129-I131 HydrophobicContact CG2-CG1 3.81Å
130	T	98.1	Very high	94.4	Very high	61 Å²	61	59.7 Å²	59.7	37%	0.374	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.8	171.3	-54.4	0	0	0	0	109.9	I112 Y113	I112-T130 HydrophobicContact CG2-CG2 3.13Å; Y113-T130 CarbonylContact O-C 3.44Å; Y113-T130 WeakPolarHBondContact O-CA 3.16Å
131	I	98.5	Very high	94.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125	-179.8	-55.8	179.5	0	0	0	108.2	R39 P41 L51 S52 W67 I112 Y113 I129	R39-I131 CarbonylContact O-C 3.52Å; R39-I131 WeakPolarHBondContact O-CA 3.47Å; P41-I131 HydrophobicContact CG-CG2 3.68Å; L51-I131 HydrophobicContact CB-CD1 4.1Å; L51-I131 HydrophobicContact CD2-CG2 4.07Å; S52-I131 WeakPolarHBondContact O-CD1 3.44Å; W67-I131 HydrophobicContact CH2-CD1 3.76Å; W67-I131 HydrophobicContact CZ3-CD1 4.14Å; I112-I131 CarbonylContact C-O 3.6Å; I112-I131 WeakPolarHBondContact CA-O 3.34Å; Y113-I131 PolarHBondContact N-O 2.88Å; Y113-I131 PolarHBondContact O-N 3.12Å; I129-I131 HydrophobicContact CG2-CD1 4.36Å; I129-I131 HydrophobicContact CG2-CG1 3.81Å
132	E	98.3	Very high	95.4	Very high	90 Å²	90	52.6 Å²	52.6	42%	0.421	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	104.2	176.4	-175.6	177.8	-158.8	0	0	109.3	R39 N40 P41 I112	R39-E132 PolarHBondContact O-N 3.45Å; N40-E132 WeakPolarHBondContact CA-O 3.38Å; N40-E132 PolarHBondContact ND2-OE2 2.95Å; P41-E132 WeakPolarHBondContact CD-O 3.31Å; I112-E132 HydrophobicContact CG1-CG 4.45Å
133	L	98.4	Very high	96	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.5	177.4	175	62.4	0	0	0	109.7	P41 V43 V49 L51 I102 S110 A111 Y113 V135	P41-L133 HydrophobicContact CB-CD1 4.27Å; P41-L133 HydrophobicContact CG-CD1 3.97Å; V43-L133 HydrophobicContact CG1-CD1 3.86Å; V49-L133 HydrophobicContact CB-CD1 4.39Å; V49-L133 HydrophobicContact CG1-CD1 3.92Å; V49-L133 HydrophobicContact CG1-CD2 4.04Å; V49-L133 HydrophobicContact CG2-CD1 3.9Å; L51-L133 HydrophobicContact CD2-CB 4.31Å; L51-L133 HydrophobicContact CD2-CD1 4.29Å; L51-L133 HydrophobicContact CD2-CD2 4.41Å; I102-L133 HydrophobicContact CD1-CD2 4.38Å; S110-L133 WeakPolarHBondContact CA-O 3.38Å; A111-L133 PolarHBondContact N-O 3.24Å; A111-L133 PolarHBondContact O-N 2.98Å; Y113-L133 HydrophobicContact CD2-CB 3.93Å; Y113-L133 HydrophobicContact CE2-CB 3.8Å; Y113-L133 HydrophobicContact CE2-CD2 3.81Å; Y113-L133 HydrophobicContact CE2-CG 4.43Å; L133-V135 HydrophobicContact CD2-CG2 4.39Å; L133-V135 HydrophobicContact CG-CG2 4.29Å
134	I	98	Very high	96.7	Very high	45 Å²	45	48 Å²	48	23%	0.231	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	116.6	173.4	-63	173.7	0	0	0	109.2	P41 V42 V43 Q136 Y166	P41-I134 PolarHBondContact O-N 3.05Å; V42-I134 WeakPolarHBondContact CA-O 3.34Å; V42-I134 HydrophobicContact CG2-CB 4.4Å; V43-I134 PolarHBondContact N-O 3.17Å; V43-I134 VanDerWaalsContact N-O 3.08Å; I134-Q136 HydrophobicContact CG2-CG 4.41Å; I134-Y166 HydrophobicContact CG2-CD1 4.5Å; I134-Y166 HydrophobicContact CG2-CE1 3.81Å
135	V	98.3	Very high	97.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	116.2	171.8	-174.5	0	0	0	0	108.9	V43 E45 V105 D109 S110 L133	V43-V135 HydrophobicContact CG1-CG2 4.03Å; V43-V135 CarbonylContact O-C 3.59Å; V43-V135 WeakPolarHBondContact O-CA 3.37Å; E45-V135 HydrophobicContact CB-CG1 4.14Å; E45-V135 HydrophobicContact CG-CG1 4.44Å; V105-V135 HydrophobicContact CB-CG2 4.27Å; V105-V135 HydrophobicContact CG2-CG1 4.03Å; V105-V135 HydrophobicContact CG2-CG2 4.38Å; D109-V135 HydrophobicContact CB-CG2 4.47Å; S110-V135 VanDerWaalsContact OG-CB 3.31Å; S110-V135 WeakPolarHBondContact OG-CB 3.46Å; S110-V135 PolarHBondContact OG-N 3.28Å; L133-V135 HydrophobicContact CD2-CG2 4.39Å; L133-V135 HydrophobicContact CG-CG2 4.29Å
136	Q	98.2	Very high	97.6	Very high	21 Å²	21	46.5 Å²	46.5	10%	0.098	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	137.6	176.3	-53.9	-176.8	-36.3	0	0	110.6	V42 V43 H44 E45 I134 Y166 A225	V42-Q136 HydrophobicContact CG1-CG 3.48Å; V42-Q136 VanDerWaalsContact CG1-CG 3.48Å; V43-Q136 PolarHBondContact O-N 3.34Å; H44-Q136 WeakPolarHBondContact CA-O 3.42Å; E45-Q136 PolarHBondContact N-O 3.48Å; I134-Q136 HydrophobicContact CG2-CG 4.41Å; Q136-Y166 CarbonylContact C-O 3.59Å; Q136-Y166 VanDerWaalsContact CA-O 3.25Å; Q136-Y166 WeakPolarHBondContact CA-O 3.03Å; Q136-Y166 WeakPolarHBondContact CB-O 3.25Å; Q136-A225 HydrophobicContact CB-CB 3.77Å
137	V	98	Very high	97.8	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.03	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-116.6	122.7	-179.6	-177.3	0	0	0	0	107.6	E45 R107 E164 G165 Y166 N223	E45-V137 HydrophobicContact CB-CG2 4.38Å; R107-V137 HydrophobicContact CB-CG2 3.89Å; V137-E164 WeakPolarHBondContact CG1-O 3.23Å; V137-G165 WeakPolarHBondContact O-CA 3.49Å; V137-Y166 PolarHBondContact N-O 2.94Å; V137-Y166 PolarHBondContact O-N 2.82Å; V137-Y166 VanDerWaalsContact O-O 3.13Å; V137-N223 PolarHBondContact O-ND2 2.84Å
138	K	97.2	Very high	98	Very high	119 Å²	119	52 Å²	52	52%	0.517	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-63.9	140.8	174.6	-178.6	179.9	173.8	179.7	0	110	A225 A227	K138-A225 HydrophobicContact CB-CB 4.25Å; K138-A227 WeakPolarHBondContact CE-O 3.19Å; K138-A227 PolarHBondContact NZ-O 3.02Å
139	P	97.8	Very high	98	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.026	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-61.5	140	178.5	-20.8	34.7	0	0	0	111	E162 P169 A221 N223 G226 S228	P139-E162 HydrophobicContact CB-CG 3.85Å; P139-P169 HydrophobicContact CB-CB 4.41Å; P139-P169 HydrophobicContact CG-CB 3.95Å; P139-A221 HydrophobicContact CB-CB 4.21Å; P139-N223 WeakPolarHBondContact CD-OD1 3.35Å; P139-N223 HydrophobicContact CG-CB 4.32Å; P139-G226 WeakPolarHBondContact CD-O 3.31Å; P139-S228 VanDerWaalsContact O-CB 3.3Å; P139-S228 WeakPolarHBondContact O-CB 3.41Å; P139-S228 PolarHBondContact O-OG 3.22Å
140	V	96.7	Very high	98	Very high	72 Å²	72	50.2 Å²	50.2	44%	0.436	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-79.5	169.8	170.8	-59.7	0	0	0	0	110.1	P142 E162 E164 S228	V140-P142 VanDerWaalsContact O-CD 3.29Å; V140-P142 WeakPolarHBondContact O-CD 3.3Å; V140-E162 HydrophobicContact CG2-CG 4.33Å; V140-E162 WeakPolarHBondContact CG2-OE1 3.37Å; V140-E162 PolarHBondContact N-OE1 2.92Å; V140-E162 VanDerWaalsContact O-CG 3.31Å; V140-E162 WeakPolarHBondContact O-CG 3.36Å; V140-E164 HydrophobicContact CG1-CB 3.95Å; V140-E164 HydrophobicContact CG1-CG 4.13Å; V140-E164 HydrophobicContact CG2-CB 4.05Å; V140-E164 HydrophobicContact CG2-CG 3.81Å; V140-S228 VanDerWaalsContact C-OG 3.28Å; V140-S228 WeakPolarHBondContact O-CB 3.5Å; V140-S228 PolarHBondContact O-OG 3.47Å
141	T	98	Very high	97.9	Very high	95 Å²	95	48.4 Å²	48.4	58%	0.583	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-52.3	116.2	176.7	-61.2	0	0	0	0	110.6	R229	T141-R229 WeakPolarHBondContact CG2-O 3.28Å
142	P	98.1	Very high	97.8	Very high	5 Å²	5	51 Å²	51	3%	0.032	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-69.1	152.5	-176.7	26	-33	0	0	0	111.3	V140 C144 Q161 E162 A221 S228 C230	V140-P142 VanDerWaalsContact O-CD 3.29Å; V140-P142 WeakPolarHBondContact O-CD 3.3Å; P142-C144 PolarHBondContact O-N 3.45Å; P142-Q161 CarbonylContact C-O 3.54Å; P142-Q161 WeakPolarHBondContact CA-O 3.24Å; P142-E162 HydrophobicContact CB-CB 4.14Å; P142-A221 HydrophobicContact CB-CB 4.18Å; P142-A221 HydrophobicContact CG-CB 4.11Å; P142-S228 WeakPolarHBondContact CD-OG 3.46Å; P142-C230 HydrophobicContact CG-CB 4.09Å; P142-C230 VanDerWaalsContact O-CB 3.25Å; P142-C230 WeakPolarHBondContact O-CB 3.42Å
143	V	98.1	Very high	97.7	Very high	87 Å²	87	49 Å²	49	53%	0.527	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	108.5	173.3	-178.4	0	0	0	0	109	Q161	V143-Q161 PolarHBondContact N-O 2.96Å; V143-Q161 PolarHBondContact O-N 2.99Å
144	C	98.3	Very high	97.6	Very high	11 Å²	11	54.4 Å²	54.4	7%	0.074	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	138.8	175.1	-70.3	0	0	0	0	111.8	P142 Q159 C230 Q233	P142-C144 PolarHBondContact O-N 3.45Å; C144-Q159 CarbonylContact C-O 3.47Å; C144-Q159 VanDerWaalsContact CA-O 3.31Å; C144-Q159 WeakPolarHBondContact CA-O 3.38Å; C144-C230 HydrophobicContact CB-CB 3.67Å; C144-C230 WeakPolarHBondContact CB-SG 3.48Å; C144-C230 WeakPolarHBondContact SG-CB 3.33Å; C144-C230 CovalentContact SG-SG 2.02Å; C144-C230 PolarHBondContact SG-SG 3.47Å; C144-Q233 PolarHBondContact O-NE2 2.84Å
145	R	98.4	Very high	97.6	Very high	141 Å²	141	58.6 Å²	58.6	53%	0.532	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	104.9	173.4	-61.6	179.5	-178.2	167.2	0	108.8	L158 Q159	R145-L158 WeakPolarHBondContact O-CA 3.32Å; R145-Q159 HydrophobicContact CB-CB 4.34Å; R145-Q159 PolarHBondContact N-O 3.3Å; R145-Q159 PolarHBondContact O-N 2.83Å; R145-Q159 VanDerWaalsContact O-N 3.09Å
146	V	98.6	Very high	97.6	Very high	14 Å²	14	58.8 Å²	58.8	9%	0.085	32%	0.316	C	S	.	.			trans	-115	127.2	177.5	-179.9	0	0	0	0	109.1	K148 L158 W173 Q233 M235	V146-K148 PolarHBondContact O-N 2.82Å; V146-L158 HydrophobicContact CB-CD2 4.35Å; V146-L158 HydrophobicContact CB-CG 4.29Å; V146-L158 HydrophobicContact CG1-CD2 3.85Å; V146-L158 HydrophobicContact CG1-CG 4.04Å; V146-L158 HydrophobicContact CG2-CD2 3.87Å; V146-L158 HydrophobicContact CG2-CG 4.04Å; V146-W173 HydrophobicContact CG2-CH2 4.16Å; V146-W173 HydrophobicContact CG2-CZ3 4.05Å; V146-Q233 HydrophobicContact CB-CB 3.68Å; V146-Q233 HydrophobicContact CG1-CB 4.31Å; V146-Q233 HydrophobicContact CG2-CB 3.86Å; V146-M235 HydrophobicContact CG1-CB 3.81Å
147	P	98.1	Very high	97.6	Very high	42 Å²	42	60.6 Å²	60.6	27%	0.273	33%	0.328	S	S	.	.			trans	-61.4	130.8	172.9	-20.1	32	0	0	0	110.4	A149 V150 L158 M235	P147-A149 VanDerWaalsContact C-N 3.3Å; P147-A149 PolarHBondContact O-N 2.93Å; P147-V150 HydrophobicContact CB-CG2 3.79Å; P147-V150 HydrophobicContact CG-CG2 4.33Å; P147-L158 HydrophobicContact CG-CD1 4.42Å; P147-M235 WeakPolarHBondContact O-CB 3.45Å; P147-M235 WeakPolarHBondContact O-CG 3.35Å
148	K	97.8	Very high	97.7	Very high	183 Å²	183	60.3 Å²	60.3	80%	0.796	33%	0.327	S	S	*	.	S	Bend	trans	-63.1	-37.6	179	-66.9	-174.2	177.7	-175.4	0	112.7	V146 E236	V146-K148 PolarHBondContact O-N 2.82Å; K148-E236 PolarHBondContact O-N 3.34Å
149	A	97.4	Very high	97.7	Very high	48 Å²	48	57.7 Å²	57.7	40%	0.397	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	140.5	-179.1	0	0	0	0	0	111.5	P147 E236 Y238	P147-A149 VanDerWaalsContact C-N 3.3Å; P147-A149 PolarHBondContact O-N 2.93Å; A149-E236 CarbonylContact C-O 3.58Å; A149-E236 WeakPolarHBondContact CA-O 3.37Å; A149-Y238 HydrophobicContact CB-CD1 3.96Å; A149-Y238 HydrophobicContact CB-CE1 3.83Å
150	V	97.8	Very high	97.7	Very high	9 Å²	9	57.5 Å²	57.5	6%	0.055	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.9	178.1	-171.6	0	0	0	0	110.1	P147 K154 A156 V209 M235 E236 V237 Y238	P147-V150 HydrophobicContact CB-CG2 3.79Å; P147-V150 HydrophobicContact CG-CG2 4.33Å; V150-K154 HydrophobicContact CG1-CB 4.18Å; V150-A156 HydrophobicContact CG1-CB 4.16Å; V150-A156 HydrophobicContact CG2-CB 4.05Å; V150-V209 HydrophobicContact CB-CG2 4.11Å; V150-V209 HydrophobicContact CG1-CG1 4.17Å; V150-V209 HydrophobicContact CG1-CG2 3.61Å; V150-M235 HydrophobicContact CG2-CG 4.3Å; V150-M235 HydrophobicContact CG2-SD 4.05Å; V150-E236 PolarHBondContact N-O 2.85Å; V150-V237 VanDerWaalsContact O-CA 3.27Å; V150-V237 WeakPolarHBondContact O-CA 3.39Å; V150-Y238 WeakPolarHBondContact O-CD1 3.43Å; V150-Y238 PolarHBondContact O-N 3.35Å
151	P	96.9	Very high	97.8	Very high	23 Å²	23	58.7 Å²	58.7	15%	0.149	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	143.5	174.8	-6.1	16.7	0	0	0	112.9	G153 K154 V209 Y238 L240	P151-G153 PolarHBondContact O-N 2.76Å; P151-K154 HydrophobicContact CB-CG 3.94Å; P151-K154 HydrophobicContact CG-CG 3.97Å; P151-K154 WeakPolarHBondContact O-CB 3.5Å; P151-K154 PolarHBondContact O-N 3.29Å; P151-K154 VanDerWaalsContact O-N 3.15Å; P151-V209 WeakPolarHBondContact O-CG2 3.45Å; P151-Y238 CarbonylContact C-O 3.54Å; P151-Y238 VanDerWaalsContact CA-O 3.25Å; P151-Y238 WeakPolarHBondContact CA-O 3.48Å; P151-Y238 HydrophobicContact CB-CE1 4.47Å; P151-Y238 HydrophobicContact CB-CE2 4.21Å; P151-Y238 HydrophobicContact CG-CE1 4.12Å; P151-Y238 HydrophobicContact CG-CE2 4.22Å; P151-L240 HydrophobicContact CB-CD1 4.09Å; P151-L240 HydrophobicContact CB-CD2 4Å; P151-L240 HydrophobicContact CB-CG 3.8Å; P151-L240 HydrophobicContact CG-CD2 4.28Å
152	V	96.6	Very high	97.7	Very high	53 Å²	53	55 Å²	55	32%	0.321	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	137	174.6	175.2	0	0	0	0	111.3	K154 V237 Y238 D239	V152-K154 PolarHBondContact O-N 3.11Å; V152-V237 HydrophobicContact CB-CG1 4.42Å; V152-V237 HydrophobicContact CG2-CG1 3.57Å; V152-Y238 PolarHBondContact N-O 2.89Å; V152-D239 WeakPolarHBondContact CG2-OD1 3.25Å
153	G	95.8	Very high	97.5	Very high	48 Å²	48	59.8 Å²	59.8	50%	0.495	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	0.2	178.3	0	0	0	0	0	114.8	P151 V209	P151-G153 PolarHBondContact O-N 2.76Å; G153-V209 PolarHBondContact N-O 3.08Å
154	K	96.7	Very high	97.4	Very high	117 Å²	117	59.2 Å²	59.2	51%	0.509	32%	0.317	S	S	.	.	S	Bend	trans	-89.9	156.9	173.1	-62	-60.6	-175	-178.7	0	111.7	V150 P151 V152 A208 V209	V150-K154 HydrophobicContact CG1-CB 4.18Å; P151-K154 HydrophobicContact CB-CG 3.94Å; P151-K154 HydrophobicContact CG-CG 3.97Å; P151-K154 WeakPolarHBondContact O-CB 3.5Å; P151-K154 PolarHBondContact O-N 3.29Å; P151-K154 VanDerWaalsContact O-N 3.15Å; V152-K154 PolarHBondContact O-N 3.11Å; K154-A208 WeakPolarHBondContact O-CA 3.44Å; K154-V209 WeakPolarHBondContact O-CG2 3.43Å; K154-V209 PolarHBondContact O-N 3.23Å
155	M	97.8	Very high	97.3	Very high	132 Å²	132	59.1 Å²	59.1	65%	0.65	32%	0.318	S	S	*	.			trans	-73.5	141.6	172.6	-171	177.5	68.5	0	0	109.8	F206	M155-F206 VanDerWaalsContact CA-O 3.31Å; M155-F206 WeakPolarHBondContact CA-O 3.48Å; M155-F206 WeakPolarHBondContact CG-O 3.45Å
156	A	98.1	Very high	97.2	Very high	6 Å²	6	58.3 Å²	58.3	5%	0.05	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.4	172.9	0	0	0	0	0	110.5	V150 V205 F206 V209	V150-A156 HydrophobicContact CG1-CB 4.16Å; V150-A156 HydrophobicContact CG2-CB 4.05Å; A156-V205 WeakPolarHBondContact O-CA 3.29Å; A156-F206 HydrophobicContact CB-CB 4.24Å; A156-F206 HydrophobicContact CB-CD2 4.18Å; A156-F206 PolarHBondContact N-O 3.36Å; A156-F206 VanDerWaalsContact N-O 3.07Å; A156-F206 PolarHBondContact O-N 3.37Å; A156-V209 HydrophobicContact CB-CG1 3.59Å
157	T	98.4	Very high	97.2	Very high	58 Å²	58	59.5 Å²	59.5	36%	0.356	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	122.5	175.8	-57.8	0	0	0	0	109.4	Q159 L204 V205	T157-Q159 HydrophobicContact CG2-CG 4.28Å; T157-L204 WeakPolarHBondContact CA-O 3.41Å; T157-V205 HydrophobicContact CG2-CG2 4.07Å
158	L	98.6	Very high	97.1	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	141.6	173.2	-76.5	63.4	0	0	0	107.7	R145 V146 P147 W173 T203 L204 F206 Y217 M235	R145-L158 WeakPolarHBondContact O-CA 3.32Å; V146-L158 HydrophobicContact CB-CD2 4.35Å; V146-L158 HydrophobicContact CB-CG 4.29Å; V146-L158 HydrophobicContact CG1-CD2 3.85Å; V146-L158 HydrophobicContact CG1-CG 4.04Å; V146-L158 HydrophobicContact CG2-CD2 3.87Å; V146-L158 HydrophobicContact CG2-CG 4.04Å; P147-L158 HydrophobicContact CG-CD1 4.42Å; L158-W173 HydrophobicContact CB-CH2 3.76Å; L158-W173 HydrophobicContact CB-CZ2 3.86Å; L158-W173 HydrophobicContact CB-CZ3 4.28Å; L158-W173 HydrophobicContact CD2-CE3 4.47Å; L158-W173 HydrophobicContact CD2-CH2 4.37Å; L158-W173 HydrophobicContact CD2-CZ3 4.07Å; L158-T203 WeakPolarHBondContact O-CA 3.31Å; L158-L204 HydrophobicContact CB-CB 4.09Å; L158-L204 HydrophobicContact CB-CD2 4.34Å; L158-L204 HydrophobicContact CB-CG 4.37Å; L158-L204 HydrophobicContact CD2-CD2 3.83Å; L158-L204 PolarHBondContact N-O 3.37Å; L158-L204 PolarHBondContact O-N 2.6Å; L158-F206 HydrophobicContact CD1-CD2 4.34Å; L158-F206 HydrophobicContact CD1-CE2 4.1Å; L158-Y217 HydrophobicContact CD2-CD1 3.53Å; L158-Y217 HydrophobicContact CD2-CD2 4.26Å; L158-Y217 HydrophobicContact CD2-CE1 3.98Å; L158-Y217 HydrophobicContact CD2-CG 3.66Å; L158-M235 HydrophobicContact CD1-SD 4.01Å
159	Q	98.4	Very high	97.1	Very high	64 Å²	64	58.9 Å²	58.9	30%	0.299	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142	-177.7	-61.2	-176.9	-24.2	0	0	110.8	C144 R145 T157	C144-Q159 CarbonylContact C-O 3.47Å; C144-Q159 VanDerWaalsContact CA-O 3.31Å; C144-Q159 WeakPolarHBondContact CA-O 3.38Å; R145-Q159 HydrophobicContact CB-CB 4.34Å; R145-Q159 PolarHBondContact N-O 3.3Å; R145-Q159 PolarHBondContact O-N 2.83Å; R145-Q159 VanDerWaalsContact O-N 3.09Å; T157-Q159 HydrophobicContact CG2-CG 4.28Å
160	C	98.1	Very high	97.1	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	121.3	175.4	-178.4	0	0	0	0	107.7	Y171 W173 G202 C219	C160-Y171 HydrophobicContact CB-CD1 4.16Å; C160-Y171 WeakPolarHBondContact SG-CD1 2.92Å; C160-W173 HydrophobicContact CB-CH2 4.23Å; C160-W173 HydrophobicContact CB-CZ2 3.58Å; C160-G202 WeakPolarHBondContact CB-O 3.49Å; C160-G202 PolarHBondContact N-O 2.85Å; C160-G202 VanDerWaalsContact N-O 3.08Å; C160-C219 HydrophobicContact CB-CB 3.52Å; C160-C219 WeakPolarHBondContact CB-SG 3.26Å; C160-C219 WeakPolarHBondContact SG-CB 3.1Å; C160-C219 CovalentContact SG-SG 2.04Å; C160-C219 PolarHBondContact SG-SG 2.89Å
161	Q	97.1	Very high	97.1	Very high	96 Å²	96	61.9 Å²	61.9	45%	0.449	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.9	-174.2	-65	179.9	14.1	0	0	111.2	P142 V143	P142-Q161 CarbonylContact C-O 3.54Å; P142-Q161 WeakPolarHBondContact CA-O 3.24Å; V143-Q161 PolarHBondContact N-O 2.96Å; V143-Q161 PolarHBondContact O-N 2.99Å
162	E	97.4	Very high	97.2	Very high	19 Å²	19	62.7 Å²	62.7	9%	0.089	32%	0.322	C	S	.	.			trans	-138.9	137.1	174.6	-159.6	-72.2	139.4	0	0	108.4	P139 V140 P142 E164 G165 P169 Y171 A221	P139-E162 HydrophobicContact CB-CG 3.85Å; V140-E162 HydrophobicContact CG2-CG 4.33Å; V140-E162 WeakPolarHBondContact CG2-OE1 3.37Å; V140-E162 PolarHBondContact N-OE1 2.92Å; V140-E162 VanDerWaalsContact O-CG 3.31Å; V140-E162 WeakPolarHBondContact O-CG 3.36Å; P142-E162 HydrophobicContact CB-CB 4.14Å; E162-E164 WeakPolarHBondContact OE1-CA 3.36Å; E162-E164 WeakPolarHBondContact OE1-CB 3.32Å; E162-E164 PolarHBondContact OE1-N 3.05Å; E162-E164 PolarHBondContact OE2-N 3.21Å; E162-G165 VanDerWaalsContact CD-N 3.34Å; E162-G165 PolarHBondContact OE1-N 3.47Å; E162-G165 WeakPolarHBondContact OE2-CA 3.33Å; E162-G165 PolarHBondContact OE2-N 3.04Å; E162-P169 HydrophobicContact CB-CG 4.1Å; E162-P169 HydrophobicContact CG-CG 4.5Å; E162-P169 WeakPolarHBondContact OE2-CG 3.48Å; E162-Y171 HydrophobicContact CB-CE1 4.02Å; E162-Y171 PolarHBondContact N-OH 3.39Å; E162-Y171 PolarHBondContact O-OH 2.9Å; E162-Y171 VanDerWaalsContact O-OH 3.08Å; E162-A221 HydrophobicContact CB-CB 4Å; E162-A221 HydrophobicContact CG-CB 4.2Å
163	S	94	Very high	97.2	Very high	104 Å²	104	60.1 Å²	60.1	73%	0.727	31%	0.307	S	S	*	.			trans	-126.6	-11.5	-171.5	58	0	0	0	0	115.1
164	E	95.3	Very high	97.4	Very high	76 Å²	76	60.3 Å²	60.3	36%	0.355	29%	0.293	S	S	.	.	S	Bend	trans	-96	-26.3	-172.7	-58.6	-58.9	130.6	0	0	112.6	R107 V137 V140 E162	R107-E164 IonicContact CZ-OE2 2.77Å; R107-E164 IonicContact NH1-OE2 3.95Å; R107-E164 PolarHBondContact NH1-OE2 2.84Å; R107-E164 IonicContact NH2-OE2 3.86Å; V137-E164 WeakPolarHBondContact CG1-O 3.23Å; V140-E164 HydrophobicContact CG1-CB 3.95Å; V140-E164 HydrophobicContact CG1-CG 4.13Å; V140-E164 HydrophobicContact CG2-CB 4.05Å; V140-E164 HydrophobicContact CG2-CG 3.81Å; E162-E164 WeakPolarHBondContact OE1-CA 3.36Å; E162-E164 WeakPolarHBondContact OE1-CB 3.32Å; E162-E164 PolarHBondContact OE1-N 3.05Å; E162-E164 PolarHBondContact OE2-N 3.21Å
165	G	96.4	Very high	97.4	Very high	9 Å²	9	56.1 Å²	56.1	9%	0.093	27%	0.273	C	S	.	.			trans	-65.5	133.3	-178.3	0	0	0	0	0	112.8	V137 E162 P167	V137-G165 WeakPolarHBondContact O-CA 3.49Å; E162-G165 VanDerWaalsContact CD-N 3.34Å; E162-G165 PolarHBondContact OE1-N 3.47Å; E162-G165 WeakPolarHBondContact OE2-CA 3.33Å; E162-G165 PolarHBondContact OE2-N 3.04Å; G165-P167 CarbonylContact C-O 3.55Å
166	Y	96.9	Very high	97.4	Very high	123 Å²	123	53.8 Å²	53.8	48%	0.482	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-133.1	127.9	172.4	-172.3	-90.7	0	0	0	110.8	I134 Q136 V137 N223	I134-Y166 HydrophobicContact CG2-CD1 4.5Å; I134-Y166 HydrophobicContact CG2-CE1 3.81Å; Q136-Y166 CarbonylContact C-O 3.59Å; Q136-Y166 VanDerWaalsContact CA-O 3.25Å; Q136-Y166 WeakPolarHBondContact CA-O 3.03Å; Q136-Y166 WeakPolarHBondContact CB-O 3.25Å; V137-Y166 PolarHBondContact N-O 2.94Å; V137-Y166 PolarHBondContact O-N 2.82Å; V137-Y166 VanDerWaalsContact O-O 3.13Å; Y166-N223 VanDerWaalsContact C-ND2 3.31Å; Y166-N223 PolarHBondContact N-ND2 2.91Å; Y166-N223 PolarHBondContact O-ND2 3.46Å
167	P	96.9	Very high	97.3	Very high	39 Å²	39	59.1 Å²	59.1	25%	0.253	29%	0.291	S	S	.	.	S	Bend	cis	-57.3	162.4	-4.3	-24.1	35.4	0	0	0	113	G165 N223	G165-P167 CarbonylContact C-O 3.55Å; P167-N223 VanDerWaalsContact O-CB 3.23Å; P167-N223 WeakPolarHBondContact O-CB 3.37Å; P167-N223 PolarHBondContact O-ND2 3.43Å
168	R	96.1	Very high	97.2	Very high	209 Å²	209	57.8 Å²	57.8	79%	0.789	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-54.4	130.6	-178.9	179.3	177.4	-75	-170.4	-2.2	109.7
169	P	97.5	Very high	97.1	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.019	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-73.3	154.5	-175.3	30	-37.1	0	0	0	113	P139 E162 A221 S222 N223	P139-P169 HydrophobicContact CB-CB 4.41Å; P139-P169 HydrophobicContact CG-CB 3.95Å; E162-P169 HydrophobicContact CB-CG 4.1Å; E162-P169 HydrophobicContact CG-CG 4.5Å; E162-P169 WeakPolarHBondContact OE2-CG 3.48Å; P169-A221 HydrophobicContact CB-CB 4.12Å; P169-A221 HydrophobicContact CG-CB 4.36Å; P169-S222 CarbonylContact C-O 3.58Å; P169-S222 VanDerWaalsContact CA-O 3.28Å; P169-S222 WeakPolarHBondContact CA-O 3.25Å; P169-N223 HydrophobicContact CB-CB 4.49Å
170	H	97.7	Very high	97.1	Very high	102 Å²	102	59 Å²	59	47%	0.472	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	153.4	161.3	-67.1	-66.5	0	0	0	110.7	S199 A221 S222	H170-S199 CarbonylContact C-O 3.52Å; H170-S199 VanDerWaalsContact CA-O 3.29Å; H170-S199 WeakPolarHBondContact CA-O 3.32Å; H170-A221 CarbonylContact O-C 3.51Å; H170-A221 WeakPolarHBondContact O-CA 3.47Å; H170-S222 PolarHBondContact N-O 3.34Å; H170-S222 PolarHBondContact O-N 2.91Å; H170-S222 PolarHBondContact O-OG 3.2Å
171	Y	98.3	Very high	97	Very high	18 Å²	18	60.5 Å²	60.5	7%	0.071	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.1	-174.2	-59.4	-82.2	0	0	0	111.4	C160 E162 S199 E200 G202 I220 A221	C160-Y171 HydrophobicContact CB-CD1 4.16Å; C160-Y171 WeakPolarHBondContact SG-CD1 2.92Å; E162-Y171 HydrophobicContact CB-CE1 4.02Å; E162-Y171 PolarHBondContact N-OH 3.39Å; E162-Y171 PolarHBondContact O-OH 2.9Å; E162-Y171 VanDerWaalsContact O-OH 3.08Å; Y171-S199 WeakPolarHBondContact CD2-O 3.33Å; Y171-S199 PolarHBondContact N-O 3.19Å; Y171-S199 WeakPolarHBondContact O-CA 2.97Å; Y171-S199 WeakPolarHBondContact O-CB 3.29Å; Y171-E200 WeakPolarHBondContact CE2-O 3.32Å; Y171-G202 VanDerWaalsContact CB-CA 3.48Å; Y171-G202 VanDerWaalsContact CD2-CA 3.46Å; Y171-G202 VanDerWaalsContact CD2-N 3.29Å; Y171-G202 VanDerWaalsContact CG-CA 3.42Å; Y171-I220 WeakPolarHBondContact CA-O 3.47Å; Y171-A221 HydrophobicContact CD1-CB 3.89Å; Y171-A221 HydrophobicContact CE1-CB 3.76Å
172	S	98.3	Very high	96.9	Very high	40 Å²	40	60.3 Å²	60.3	28%	0.28	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.1	173.9	54	0	0	0	0	110.1	C219 I220	S172-C219 CarbonylContact O-C 3.5Å; S172-C219 VanDerWaalsContact O-CA 3.27Å; S172-C219 WeakPolarHBondContact O-CA 3.4Å; S172-I220 PolarHBondContact N-O 3.39Å; S172-I220 PolarHBondContact O-N 2.83Å; S172-I220 PolarHBondContact OG-O 2.9Å
173	W	98.5	Very high	96.8	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	146.4	-179.9	-80.3	93.9	0	0	0	111.2	V146 L158 C160 L180 V197 G202 L204 Y217 C219	V146-W173 HydrophobicContact CG2-CH2 4.16Å; V146-W173 HydrophobicContact CG2-CZ3 4.05Å; L158-W173 HydrophobicContact CB-CH2 3.76Å; L158-W173 HydrophobicContact CB-CZ2 3.86Å; L158-W173 HydrophobicContact CB-CZ3 4.28Å; L158-W173 HydrophobicContact CD2-CE3 4.47Å; L158-W173 HydrophobicContact CD2-CH2 4.37Å; L158-W173 HydrophobicContact CD2-CZ3 4.07Å; C160-W173 HydrophobicContact CB-CH2 4.23Å; C160-W173 HydrophobicContact CB-CZ2 3.58Å; W173-L180 HydrophobicContact CB-CB 4.35Å; W173-L180 HydrophobicContact CB-CD1 4.03Å; W173-L180 HydrophobicContact CB-CG 4.45Å; W173-L180 PolarHBondContact O-N 3.24Å; W173-V197 HydrophobicContact CB-CG2 4.39Å; W173-G202 PolarHBondContact NE1-O 2.83Å; W173-L204 HydrophobicContact CB-CD2 4.08Å; W173-L204 HydrophobicContact CD2-CB 4.07Å; W173-L204 HydrophobicContact CD2-CD2 3.87Å; W173-L204 HydrophobicContact CE3-CD2 4.13Å; W173-L204 HydrophobicContact CG-CB 3.97Å; W173-L204 HydrophobicContact CG-CD2 3.87Å; W173-Y217 HydrophobicContact CE3-CD1 4.42Å; W173-C219 HydrophobicContact CD2-CB 3.86Å; W173-C219 HydrophobicContact CE3-CB 3.89Å; W173-C219 HydrophobicContact CG-CB 4.47Å; W173-C219 HydrophobicContact CH2-CB 4.12Å; W173-C219 HydrophobicContact CZ2-CB 4.1Å; W173-C219 HydrophobicContact CZ3-CB 4.01Å
174	Y	98.4	Very high	96.8	Very high	52 Å²	52	56.2 Å²	56.2	20%	0.204	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.2	177	-70.6	-106.1	0	0	0	109.4	V178 P179 Y217 Y218 I220	Y174-V178 CarbonylContact C-O 3.5Å; Y174-V178 VanDerWaalsContact CA-O 3.29Å; Y174-V178 WeakPolarHBondContact CA-O 3.31Å; Y174-P179 HydrophobicContact CD1-CB 4Å; Y174-P179 HydrophobicContact CE1-CB 3.58Å; Y174-P179 HydrophobicContact CE1-CG 4.17Å; Y174-Y217 WeakPolarHBondContact O-CA 3.42Å; Y174-Y218 VanDerWaalsContact CB-CE1 3.49Å; Y174-Y218 WeakPolarHBondContact CB-OH 3.27Å; Y174-Y218 HydrophobicContact CD1-CE2 4.13Å; Y174-Y218 AromaticContact CD1-CZ 3.79Å; Y174-Y218 WeakPolarHBondContact CD1-OH 3.24Å; Y174-Y218 HydrophobicContact CD2-CD2 4.2Å; Y174-Y218 AromaticContact CD2-CE2 3.59Å; Y174-Y218 HydrophobicContact CD2-CE2 3.59Å; Y174-Y218 HydrophobicContact CE2-CE2 4.37Å; Y174-Y218 HydrophobicContact CG-CD2 4.27Å; Y174-Y218 HydrophobicContact CG-CE1 4.22Å; Y174-Y218 AromaticContact CG-CE2 3.47Å; Y174-Y218 HydrophobicContact CG-CE2 3.47Å; Y174-Y218 VanDerWaalsContact CG-CE2 3.47Å; Y174-Y218 AromaticContact CG-CZ 3.43Å; Y174-Y218 VanDerWaalsContact CG-CZ 3.43Å; Y174-Y218 PolarHBondContact N-O 3.24Å; Y174-Y218 PolarHBondContact O-N 3.33Å; Y174-I220 HydrophobicContact CD2-CD1 4.1Å; Y174-I220 HydrophobicContact CD2-CG1 4.06Å; Y174-I220 HydrophobicContact CE2-CB 4.45Å; Y174-I220 HydrophobicContact CE2-CD1 3.47Å; Y174-I220 VanDerWaalsContact CE2-CD1 3.47Å; Y174-I220 HydrophobicContact CE2-CG1 3.76Å
175	R	97.8	Very high	96.6	Very high	28 Å²	28	61.2 Å²	61.2	11%	0.106	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118.1	172.4	-176.3	174.3	79.4	-170.8	10.5	109.1	D177 V178 L180 D212 D213 Q216 Y217	R175-D177 VanDerWaalsContact C-N 3.28Å; R175-D177 PolarHBondContact O-N 3.07Å; R175-V178 PolarHBondContact N-O 2.02Å; R175-V178 WeakPolarHBondContact O-CB 3.46Å; R175-V178 PolarHBondContact O-N 2.86Å; R175-L180 HydrophobicContact CB-CD1 4.36Å; R175-L180 HydrophobicContact CB-CD2 3.94Å; R175-L180 HydrophobicContact CB-CG 4.34Å; R175-D212 PolarHBondContact NH2-O 2.85Å; R175-D213 IonicContact CZ-OD1 3.12Å; R175-D213 IonicContact NH1-OD1 3.97Å; R175-D213 PolarHBondContact NH1-OD1 2.97Å; R175-D213 IonicContact NH2-OD1 2.82Å; R175-Q216 WeakPolarHBondContact CA-O 3.33Å; R175-Y217 HydrophobicContact CB-CD1 4.22Å; R175-Y217 HydrophobicContact CB-CE1 3.96Å; R175-Y217 WeakPolarHBondContact CD-OH 3.39Å; R175-Y217 HydrophobicContact CG-CD1 4.47Å; R175-Y217 HydrophobicContact CG-CD2 4.47Å; R175-Y217 HydrophobicContact CG-CE1 4.02Å; R175-Y217 HydrophobicContact CG-CE2 3.97Å; R175-Y217 PolarHBondContact NH1-OH 2.91Å
176	N	96.8	Very high	96.4	Very high	84 Å²	84	64.5 Å²	64.5	45%	0.449	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	50.1	-176.2	-54.5	-31	0	0	0	111.5	V178 G215 Q216	N176-V178 PolarHBondContact O-N 3.26Å; N176-V178 VanDerWaalsContact O-N 3.07Å; N176-G215 WeakPolarHBondContact OD1-CA 3.2Å; N176-Q216 PolarHBondContact N-O 3.07Å; N176-Q216 PolarHBondContact OD1-N 3.31Å
177	D	96.7	Very high	96.1	Very high	117 Å²	117	61.6 Å²	61.6	63%	0.626	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	8.1	-176.6	-54.1	-51.9	0	0	0	116.1	R175 Y218	R175-D177 VanDerWaalsContact C-N 3.28Å; R175-D177 PolarHBondContact O-N 3.07Å; D177-Y218 WeakPolarHBondContact OD1-CE1 3.35Å
178	V	96.4	Very high	95.7	Very high	31 Å²	31	65.3 Å²	65.3	19%	0.188	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125	175.8	-172.6	0	0	0	0	109.8	Y174 R175 N176 L180 F190	Y174-V178 CarbonylContact C-O 3.5Å; Y174-V178 VanDerWaalsContact CA-O 3.29Å; Y174-V178 WeakPolarHBondContact CA-O 3.31Å; R175-V178 PolarHBondContact N-O 2.02Å; R175-V178 WeakPolarHBondContact O-CB 3.46Å; R175-V178 PolarHBondContact O-N 2.86Å; N176-V178 PolarHBondContact O-N 3.26Å; N176-V178 VanDerWaalsContact O-N 3.07Å; V178-L180 PolarHBondContact O-N 3.08Å; V178-F190 HydrophobicContact CG1-CZ 3.78Å
179	P	97.1	Very high	95.4	Very high	74 Å²	74	63.7 Å²	63.7	48%	0.481	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	135.1	176.2	25.4	-32.8	0	0	0	110.8	Y174	Y174-P179 HydrophobicContact CD1-CB 4Å; Y174-P179 HydrophobicContact CE1-CB 3.58Å; Y174-P179 HydrophobicContact CE1-CG 4.17Å
180	L	97.3	Very high	95.1	Very high	15 Å²	15	63.9 Å²	63.9	8%	0.079	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-88.7	128.6	174.2	-59.6	-176	0	0	0	109.7	W173 R175 V178 F190 F195 V197 L204 Y217	W173-L180 HydrophobicContact CB-CB 4.35Å; W173-L180 HydrophobicContact CB-CD1 4.03Å; W173-L180 HydrophobicContact CB-CG 4.45Å; W173-L180 PolarHBondContact O-N 3.24Å; R175-L180 HydrophobicContact CB-CD1 4.36Å; R175-L180 HydrophobicContact CB-CD2 3.94Å; R175-L180 HydrophobicContact CB-CG 4.34Å; V178-L180 PolarHBondContact O-N 3.08Å; L180-F190 HydrophobicContact CD2-CD1 4.35Å; L180-F190 HydrophobicContact CD2-CE1 3.72Å; L180-F190 HydrophobicContact CD2-CE2 4.37Å; L180-F190 HydrophobicContact CD2-CZ 3.73Å; L180-F195 HydrophobicContact CB-CE2 4.09Å; L180-F195 HydrophobicContact CB-CZ 4.15Å; L180-F195 HydrophobicContact CD2-CE1 4.11Å; L180-F195 HydrophobicContact CD2-CZ 3.99Å; L180-F195 HydrophobicContact CG-CZ 4.49Å; L180-V197 HydrophobicContact CB-CG2 4.33Å; L180-L204 HydrophobicContact CD1-CD1 4.26Å; L180-L204 HydrophobicContact CD1-CD2 3.71Å; L180-Y217 HydrophobicContact CD1-CD1 4.46Å; L180-Y217 HydrophobicContact CD1-CE1 4.03Å
181	P	96.3	Very high	94.6	Very high	31 Å²	31	65.4 Å²	65.4	20%	0.201	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-65.6	168.8	171.6	29.3	-37	0	0	0	111.7	D183 A186 N187 F190 F195	P181-D183 VanDerWaalsContact CG-O 3.3Å; P181-D183 WeakPolarHBondContact CG-O 2.96Å; P181-D183 PolarHBondContact O-N 2.88Å; P181-A186 HydrophobicContact CB-CB 4.38Å; P181-N187 HydrophobicContact CG-CB 4.15Å; P181-F190 VanDerWaalsContact CD-CE2 3.44Å; P181-F190 HydrophobicContact CG-CD2 3.84Å; P181-F190 HydrophobicContact CG-CE2 4.23Å; P181-F195 HydrophobicContact CG-CE2 4.17Å; P181-F195 HydrophobicContact CG-CZ 4.1Å; P181-F195 WeakPolarHBondContact O-CE2 2.95Å
182	T	95.1	Very high	94.1	Very high	92 Å²	92	69.9 Å²	69.9	56%	0.564	37%	0.367	S	S	*	.	S	Bend	trans	-58.1	-37.9	174.4	-47.5	0	0	0	0	112.3	L196 V197	T182-L196 WeakPolarHBondContact O-CA 3.42Å; T182-L196 WeakPolarHBondContact O-CD1 3.27Å; T182-V197 VanDerWaalsContact CG2-O 3.28Å; T182-V197 WeakPolarHBondContact CG2-O 3.44Å; T182-V197 PolarHBondContact O-N 3.49Å
183	D	94.6	Very high	93.9	Very high	36 Å²	36	68.5 Å²	68.5	19%	0.193	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-129.8	130.1	177.4	-173.5	-20.8	0	0	0	109	P181 R185 A186 L196	P181-D183 VanDerWaalsContact CG-O 3.3Å; P181-D183 WeakPolarHBondContact CG-O 2.96Å; P181-D183 PolarHBondContact O-N 2.88Å; D183-R185 PolarHBondContact O-N 2.86Å; D183-R185 WeakPolarHBondContact OD1-CB 3.49Å; D183-R185 IonicContact OD1-CZ 3.25Å; D183-R185 PolarHBondContact OD1-N 3.45Å; D183-R185 IonicContact OD1-NE 3.66Å; D183-R185 IonicContact OD1-NH2 2.67Å; D183-R185 IonicContact OD2-CZ 3.48Å; D183-R185 VanDerWaalsContact OD2-CZ 3.25Å; D183-R185 IonicContact OD2-NE 3.26Å; D183-R185 PolarHBondContact OD2-NE 2.81Å; D183-R185 IonicContact OD2-NH2 2.68Å; D183-R185 PolarHBondContact OD2-NH2 2.84Å; D183-A186 VanDerWaalsContact O-CB 3.24Å; D183-A186 WeakPolarHBondContact O-CB 3.43Å; D183-A186 PolarHBondContact O-N 3.4Å; D183-L196 HydrophobicContact CB-CD1 4.29Å
184	S	93.7	Very high	93.7	Very high	2 Å²	2	69.9 Å²	69.9	1%	0.014	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-50.4	-35.1	173.2	49.9	0	0	0	0	113.3	A186 N187 S193 F195	S184-A186 VanDerWaalsContact C-N 3.25Å; S184-A186 PolarHBondContact O-N 2.04Å; S184-N187 PolarHBondContact O-N 3.46Å; S184-N187 VanDerWaalsContact O-O 3.13Å; S184-S193 PolarHBondContact OG-O 2.93Å; S184-F195 PolarHBondContact N-O 2.98Å; S184-F195 PolarHBondContact OG-N 2.9Å; S184-F195 PolarHBondContact OG-O 3.32Å; S184-F195 VanDerWaalsContact OG-O 3.07Å
185	R	91.9	Very high	93.6	Very high	180 Å²	180	67.5 Å²	67.5	68%	0.679	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-69.8	-18.7	178.4	-65.3	-178.5	-67.9	-99.6	-2.3	114.1	D183 N187	D183-R185 PolarHBondContact O-N 2.86Å; D183-R185 WeakPolarHBondContact OD1-CB 3.49Å; D183-R185 IonicContact OD1-CZ 3.25Å; D183-R185 PolarHBondContact OD1-N 3.45Å; D183-R185 IonicContact OD1-NE 3.66Å; D183-R185 IonicContact OD1-NH2 2.67Å; D183-R185 IonicContact OD2-CZ 3.48Å; D183-R185 VanDerWaalsContact OD2-CZ 3.25Å; D183-R185 IonicContact OD2-NE 3.26Å; D183-R185 PolarHBondContact OD2-NE 2.81Å; D183-R185 IonicContact OD2-NH2 2.68Å; D183-R185 PolarHBondContact OD2-NH2 2.84Å; R185-N187 PolarHBondContact O-N 2.87Å
186	A	91.4	Very high	93.6	Very high	78 Å²	78	70.8 Å²	70.8	65%	0.645	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-71.5	-15.9	-178.5	0	0	0	0	0	112.8	P181 D183 S184	P181-A186 HydrophobicContact CB-CB 4.38Å; D183-A186 VanDerWaalsContact O-CB 3.24Å; D183-A186 WeakPolarHBondContact O-CB 3.43Å; D183-A186 PolarHBondContact O-N 3.4Å; S184-A186 VanDerWaalsContact C-N 3.25Å; S184-A186 PolarHBondContact O-N 2.04Å
187	N	90.5	Very high	93.7	Very high	63 Å²	63	67.1 Å²	67.1	34%	0.337	36%	0.358	S	S	.	.	S	Bend	trans	-134.7	122.7	-179.5	-175.7	-23.2	0	0	0	110.4	P181 S184 R185 R189 F190	P181-N187 HydrophobicContact CG-CB 4.15Å; S184-N187 PolarHBondContact O-N 3.46Å; S184-N187 VanDerWaalsContact O-O 3.13Å; R185-N187 PolarHBondContact O-N 2.87Å; N187-R189 PolarHBondContact O-N 3.09Å; N187-R189 WeakPolarHBondContact OD1-CB 3.38Å; N187-R189 PolarHBondContact OD1-N 2.95Å; N187-F190 HydrophobicContact CB-CD2 3.99Å; N187-F190 PolarHBondContact O-N 3.08Å
188	P	89.6	Confident	93.7	Very high	116 Å²	116	64.5 Å²	64.5	75%	0.753	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-53.1	-28	179.8	-27.5	34.8	0	0	0	114.6	F190 H191	P188-F190 PolarHBondContact O-N 2.96Å; P188-H191 WeakPolarHBondContact O-CB 3.28Å; P188-H191 PolarHBondContact O-N 2.81Å
189	R	89.6	Confident	93.7	Very high	176 Å²	176	65.2 Å²	65.2	66%	0.664	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-59.3	-27.2	176.5	-172.4	176.9	-177.2	162.8	2.3	113	N187	N187-R189 PolarHBondContact O-N 3.09Å; N187-R189 WeakPolarHBondContact OD1-CB 3.38Å; N187-R189 PolarHBondContact OD1-N 2.95Å
190	F	92	Very high	93.7	Very high	6 Å²	6	68.1 Å²	68.1	3%	0.026	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-112.5	13.3	-176	-56.2	-64.9	0	0	0	113.2	V178 L180 P181 N187 P188 N192 S193 F195	V178-F190 HydrophobicContact CG1-CZ 3.78Å; L180-F190 HydrophobicContact CD2-CD1 4.35Å; L180-F190 HydrophobicContact CD2-CE1 3.72Å; L180-F190 HydrophobicContact CD2-CE2 4.37Å; L180-F190 HydrophobicContact CD2-CZ 3.73Å; P181-F190 VanDerWaalsContact CD-CE2 3.44Å; P181-F190 HydrophobicContact CG-CD2 3.84Å; P181-F190 HydrophobicContact CG-CE2 4.23Å; N187-F190 HydrophobicContact CB-CD2 3.99Å; N187-F190 PolarHBondContact O-N 3.08Å; P188-F190 PolarHBondContact O-N 2.96Å; F190-N192 PolarHBondContact O-N 2.85Å; F190-N192 VanDerWaalsContact O-N 3.12Å; F190-S193 WeakPolarHBondContact O-CB 3.43Å; F190-S193 PolarHBondContact O-N 2.91Å; F190-F195 HydrophobicContact CB-CE1 3.83Å; F190-F195 HydrophobicContact CB-CZ 3.91Å; F190-F195 HydrophobicContact CD1-CE1 4.01Å; F190-F195 HydrophobicContact CD1-CZ 4.28Å; F190-F195 HydrophobicContact CD2-CZ 4.12Å; F190-F195 AromaticContact CG-CE1 3.92Å; F190-F195 HydrophobicContact CG-CE1 3.92Å; F190-F195 AromaticContact CG-CZ 3.86Å; F190-F195 HydrophobicContact CG-CZ 3.86Å
191	H	85.6	Confident	93.7	Very high	134 Å²	134	70.8 Å²	70.8	62%	0.62	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.5	-176.9	-174.7	-81.8	0	0	0	113.9	P188 S193	P188-H191 WeakPolarHBondContact O-CB 3.28Å; P188-H191 PolarHBondContact O-N 2.81Å; H191-S193 VanDerWaalsContact C-N 3.28Å
192	N	88.7	Confident	93.7	Very high	112 Å²	112	69.3 Å²	69.3	60%	0.599	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-4.4	176.5	-66.4	-11.8	0	0	0	113.4	F190 H210	F190-N192 PolarHBondContact O-N 2.85Å; F190-N192 VanDerWaalsContact O-N 3.12Å; N192-H210 PolarHBondContact O-CE1 3.43Å; N192-H210 PolarHBondContact O-ND1 3.34Å; N192-H210 VanDerWaalsContact O-ND1 3.09Å
193	S	93.1	Very high	93.9	Very high	11 Å²	11	66.8 Å²	66.8	8%	0.077	35%	0.349	C	S	.	.			trans	-98	162.7	176.3	-161.4	0	0	0	0	110.8	S184 F190 H191 F195 D213	S184-S193 PolarHBondContact OG-O 2.93Å; F190-S193 WeakPolarHBondContact O-CB 3.43Å; F190-S193 PolarHBondContact O-N 2.91Å; H191-S193 VanDerWaalsContact C-N 3.28Å; S193-F195 WeakPolarHBondContact OG-CD1 3.46Å; S193-D213 VanDerWaalsContact CB-OD1 3.3Å; S193-D213 WeakPolarHBondContact CB-OD1 3.3Å; S193-D213 VanDerWaalsContact OG-CG 3.27Å; S193-D213 PolarHBondContact OG-OD1 3Å; S193-D213 PolarHBondContact OG-OD2 3.37Å
194	S	95	Very high	94	Very high	29 Å²	29	65 Å²	65	20%	0.203	34%	0.34	C	S	.	.			trans	-124.5	26.3	-174.7	74.6	0	0	0	0	112.7	S207 A208	S194-S207 VanDerWaalsContact CB-OG 3.24Å; S194-S207 WeakPolarHBondContact CB-OG 3.5Å; S194-S207 PolarHBondContact O-N 3.46Å; S194-S207 PolarHBondContact O-OG 3.42Å; S194-S207 PolarHBondContact OG-N 2.93Å; S194-S207 PolarHBondContact OG-OG 3.07Å; S194-A208 PolarHBondContact OG-N 3.15Å; S194-A208 PolarHBondContact OG-O 3.36Å
195	F	97	Very high	94.3	Very high	2 Å²	2	67.2 Å²	67.2	1%	0.009	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	153.1	-174.9	71.4	-106.4	0	0	0	114.7	L180 P181 S184 F190 S193 V197 L204 V205 F206	L180-F195 HydrophobicContact CB-CE2 4.09Å; L180-F195 HydrophobicContact CB-CZ 4.15Å; L180-F195 HydrophobicContact CD2-CE1 4.11Å; L180-F195 HydrophobicContact CD2-CZ 3.99Å; L180-F195 HydrophobicContact CG-CZ 4.49Å; P181-F195 HydrophobicContact CG-CE2 4.17Å; P181-F195 HydrophobicContact CG-CZ 4.1Å; P181-F195 WeakPolarHBondContact O-CE2 2.95Å; S184-F195 PolarHBondContact N-O 2.98Å; S184-F195 PolarHBondContact OG-N 2.9Å; S184-F195 PolarHBondContact OG-O 3.32Å; S184-F195 VanDerWaalsContact OG-O 3.07Å; F190-F195 HydrophobicContact CB-CE1 3.83Å; F190-F195 HydrophobicContact CB-CZ 3.91Å; F190-F195 HydrophobicContact CD1-CE1 4.01Å; F190-F195 HydrophobicContact CD1-CZ 4.28Å; F190-F195 HydrophobicContact CD2-CZ 4.12Å; F190-F195 AromaticContact CG-CE1 3.92Å; F190-F195 HydrophobicContact CG-CE1 3.92Å; F190-F195 AromaticContact CG-CZ 3.86Å; F190-F195 HydrophobicContact CG-CZ 3.86Å; S193-F195 WeakPolarHBondContact OG-CD1 3.46Å; F195-V197 HydrophobicContact CD2-CG2 4.29Å; F195-L204 HydrophobicContact CB-CD1 3.61Å; F195-L204 HydrophobicContact CD2-CD1 3.9Å; F195-L204 HydrophobicContact CG-CD1 3.88Å; F195-V205 CarbonylContact C-O 3.57Å; F195-V205 WeakPolarHBondContact CA-O 3.34Å; F195-F206 HydrophobicContact CB-CD1 3.73Å; F195-F206 HydrophobicContact CB-CD2 4.48Å; F195-F206 HydrophobicContact CB-CE1 3.63Å; F195-F206 HydrophobicContact CB-CE2 4.39Å; F195-F206 HydrophobicContact CB-CG 4.14Å; F195-F206 HydrophobicContact CB-CZ 3.94Å; F195-F206 AromaticContact CD1-CE1 3.84Å; F195-F206 HydrophobicContact CD1-CE1 3.84Å; F195-F206 HydrophobicContact CD1-CZ 4.29Å; F195-F206 HydrophobicContact CG-CE1 4.17Å; F195-F206 HydrophobicContact CG-CZ 4.43Å
196	L	97.8	Very high	94.6	Very high	97 Å²	97	58.6 Å²	58.6	51%	0.508	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	131	166.9	-169.4	78.3	0	0	0	109.3	T182 D183 L204 V205	T182-L196 WeakPolarHBondContact O-CA 3.42Å; T182-L196 WeakPolarHBondContact O-CD1 3.27Å; D183-L196 HydrophobicContact CB-CD1 4.29Å; L196-L204 WeakPolarHBondContact O-CA 3.17Å; L196-V205 PolarHBondContact N-O 3.38Å; L196-V205 PolarHBondContact O-N 3.13Å
197	V	98	Very high	94.9	Very high	8 Å²	8	58.9 Å²	58.9	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	131.2	172.8	175	0	0	0	0	108.9	W173 L180 T182 F195 T203 L204	W173-V197 HydrophobicContact CB-CG2 4.39Å; L180-V197 HydrophobicContact CB-CG2 4.33Å; T182-V197 VanDerWaalsContact CG2-O 3.28Å; T182-V197 WeakPolarHBondContact CG2-O 3.44Å; T182-V197 PolarHBondContact O-N 3.49Å; F195-V197 HydrophobicContact CD2-CG2 4.29Å; V197-T203 WeakPolarHBondContact CA-O 3.15Å; V197-L204 HydrophobicContact CG2-CB 4.41Å; V197-L204 HydrophobicContact CG2-CD1 3.62Å
198	N	97.7	Very high	95.2	Very high	62 Å²	62	57.2 Å²	57.2	33%	0.332	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	107.4	166.4	-179.6	-41.8	0	0	0	108.7	E200 T201 G202 T203	N198-E200 PolarHBondContact O-N 3.48Å; N198-E200 PolarHBondContact OD1-N 2.84Å; N198-T201 WeakPolarHBondContact CB-OG1 3.43Å; N198-T201 PolarHBondContact ND2-OG1 3.19Å; N198-T201 PolarHBondContact OD1-N 2.86Å; N198-T201 PolarHBondContact OD1-OG1 3.4Å; N198-T201 VanDerWaalsContact OD1-OG1 3.07Å; N198-G202 WeakPolarHBondContact O-CA 3.36Å; N198-G202 PolarHBondContact O-N 2.89Å; N198-T203 PolarHBondContact N-O 2.84Å; N198-T203 PolarHBondContact O-N 2.87Å
199	S	96.8	Very high	95.5	Very high	46 Å²	46	51.7 Å²	51.7	32%	0.322	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.5	-176.7	55.8	0	0	0	0	114.1	H170 Y171	H170-S199 CarbonylContact C-O 3.52Å; H170-S199 VanDerWaalsContact CA-O 3.29Å; H170-S199 WeakPolarHBondContact CA-O 3.32Å; Y171-S199 WeakPolarHBondContact CD2-O 3.33Å; Y171-S199 PolarHBondContact N-O 3.19Å; Y171-S199 WeakPolarHBondContact O-CA 2.97Å; Y171-S199 WeakPolarHBondContact O-CB 3.29Å
200	E	96	Very high	95.8	Very high	135 Å²	135	47 Å²	47	63%	0.631	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-36.3	177.6	-62.4	-179.7	177.7	0	0	112.1	Y171 N198	Y171-E200 WeakPolarHBondContact CE2-O 3.32Å; N198-E200 PolarHBondContact O-N 3.48Å; N198-E200 PolarHBondContact OD1-N 2.84Å
201	T	96.4	Very high	96	Very high	71 Å²	71	52.7 Å²	52.7	44%	0.436	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-12.1	-179.2	61.7	0	0	0	0	113.4	N198 T203	N198-T201 WeakPolarHBondContact CB-OG1 3.43Å; N198-T201 PolarHBondContact ND2-OG1 3.19Å; N198-T201 PolarHBondContact OD1-N 2.86Å; N198-T201 PolarHBondContact OD1-OG1 3.4Å; N198-T201 VanDerWaalsContact OD1-OG1 3.07Å; T201-T203 PolarHBondContact O-N 2.91Å; T201-T203 PolarHBondContact OG1-OG1 3.42Å
202	G	97.3	Very high	96.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	17	-176.2	0	0	0	0	0	113.9	C160 Y171 W173 N198	C160-G202 WeakPolarHBondContact CB-O 3.49Å; C160-G202 PolarHBondContact N-O 2.85Å; C160-G202 VanDerWaalsContact N-O 3.08Å; Y171-G202 VanDerWaalsContact CB-CA 3.48Å; Y171-G202 VanDerWaalsContact CD2-CA 3.46Å; Y171-G202 VanDerWaalsContact CD2-N 3.29Å; Y171-G202 VanDerWaalsContact CG-CA 3.42Å; W173-G202 PolarHBondContact NE1-O 2.83Å; N198-G202 WeakPolarHBondContact O-CA 3.36Å; N198-G202 PolarHBondContact O-N 2.89Å
203	T	98.3	Very high	96.8	Very high	38 Å²	38	46.4 Å²	46.4	23%	0.233	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	136.9	179.5	57.3	0	0	0	0	111.4	L158 V197 N198 T201	L158-T203 WeakPolarHBondContact O-CA 3.31Å; V197-T203 WeakPolarHBondContact CA-O 3.15Å; N198-T203 PolarHBondContact N-O 2.84Å; N198-T203 PolarHBondContact O-N 2.87Å; T201-T203 PolarHBondContact O-N 2.91Å; T201-T203 PolarHBondContact OG1-OG1 3.42Å
204	L	98.5	Very high	97	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	113.8	172.2	162	65.1	0	0	0	107.5	T157 L158 W173 L180 F195 L196 V197 F206 Y217	T157-L204 WeakPolarHBondContact CA-O 3.41Å; L158-L204 HydrophobicContact CB-CB 4.09Å; L158-L204 HydrophobicContact CB-CD2 4.34Å; L158-L204 HydrophobicContact CB-CG 4.37Å; L158-L204 HydrophobicContact CD2-CD2 3.83Å; L158-L204 PolarHBondContact N-O 3.37Å; L158-L204 PolarHBondContact O-N 2.6Å; W173-L204 HydrophobicContact CB-CD2 4.08Å; W173-L204 HydrophobicContact CD2-CB 4.07Å; W173-L204 HydrophobicContact CD2-CD2 3.87Å; W173-L204 HydrophobicContact CE3-CD2 4.13Å; W173-L204 HydrophobicContact CG-CB 3.97Å; W173-L204 HydrophobicContact CG-CD2 3.87Å; L180-L204 HydrophobicContact CD1-CD1 4.26Å; L180-L204 HydrophobicContact CD1-CD2 3.71Å; F195-L204 HydrophobicContact CB-CD1 3.61Å; F195-L204 HydrophobicContact CD2-CD1 3.9Å; F195-L204 HydrophobicContact CG-CD1 3.88Å; L196-L204 WeakPolarHBondContact O-CA 3.17Å; V197-L204 HydrophobicContact CG2-CB 4.41Å; V197-L204 HydrophobicContact CG2-CD1 3.62Å; L204-F206 HydrophobicContact CD1-CE2 4Å; L204-F206 HydrophobicContact CD1-CZ 4.17Å; L204-F206 HydrophobicContact CD2-CE2 3.92Å; L204-F206 HydrophobicContact CD2-CZ 4.21Å; L204-F206 HydrophobicContact CG-CD2 4.46Å; L204-F206 HydrophobicContact CG-CE2 3.72Å; L204-F206 HydrophobicContact CG-CZ 4.27Å; L204-Y217 HydrophobicContact CD2-CD1 3.95Å; L204-Y217 HydrophobicContact CD2-CE1 3.84Å
205	V	98.4	Very high	97.1	Very high	47 Å²	47	47 Å²	47	29%	0.285	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.3	-172.5	-178.4	0	0	0	0	109.6	A156 T157 F195 L196	A156-V205 WeakPolarHBondContact O-CA 3.29Å; T157-V205 HydrophobicContact CG2-CG2 4.07Å; F195-V205 CarbonylContact C-O 3.57Å; F195-V205 WeakPolarHBondContact CA-O 3.34Å; L196-V205 PolarHBondContact N-O 3.38Å; L196-V205 PolarHBondContact O-N 3.13Å
206	F	98.4	Very high	97.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.9	169	-63.5	-99.5	0	0	0	108.2	M155 A156 L158 F195 L204 V209 D213 Y217 M235	M155-F206 VanDerWaalsContact CA-O 3.31Å; M155-F206 WeakPolarHBondContact CA-O 3.48Å; M155-F206 WeakPolarHBondContact CG-O 3.45Å; A156-F206 HydrophobicContact CB-CB 4.24Å; A156-F206 HydrophobicContact CB-CD2 4.18Å; A156-F206 PolarHBondContact N-O 3.36Å; A156-F206 VanDerWaalsContact N-O 3.07Å; A156-F206 PolarHBondContact O-N 3.37Å; L158-F206 HydrophobicContact CD1-CD2 4.34Å; L158-F206 HydrophobicContact CD1-CE2 4.1Å; F195-F206 HydrophobicContact CB-CD1 3.73Å; F195-F206 HydrophobicContact CB-CD2 4.48Å; F195-F206 HydrophobicContact CB-CE1 3.63Å; F195-F206 HydrophobicContact CB-CE2 4.39Å; F195-F206 HydrophobicContact CB-CG 4.14Å; F195-F206 HydrophobicContact CB-CZ 3.94Å; F195-F206 AromaticContact CD1-CE1 3.84Å; F195-F206 HydrophobicContact CD1-CE1 3.84Å; F195-F206 HydrophobicContact CD1-CZ 4.29Å; F195-F206 HydrophobicContact CG-CE1 4.17Å; F195-F206 HydrophobicContact CG-CZ 4.43Å; L204-F206 HydrophobicContact CD1-CE2 4Å; L204-F206 HydrophobicContact CD1-CZ 4.17Å; L204-F206 HydrophobicContact CD2-CE2 3.92Å; L204-F206 HydrophobicContact CD2-CZ 4.21Å; L204-F206 HydrophobicContact CG-CD2 4.46Å; L204-F206 HydrophobicContact CG-CE2 3.72Å; L204-F206 HydrophobicContact CG-CZ 4.27Å; F206-V209 HydrophobicContact CB-CG1 3.64Å; F206-V209 HydrophobicContact CD1-CG1 4.28Å; F206-V209 HydrophobicContact CD2-CG1 4.48Å; F206-V209 HydrophobicContact CG-CG1 3.9Å; F206-D213 HydrophobicContact CD1-CB 4.38Å; F206-D213 HydrophobicContact CE1-CB 3.96Å; F206-Y217 HydrophobicContact CE2-CE1 4.41Å; F206-Y217 HydrophobicContact CZ-CE1 4Å; F206-Y217 AromaticContact CZ-CZ 4Å; F206-Y217 VanDerWaalsContact CZ-OH 3.26Å; F206-Y217 WeakPolarHBondContact CZ-OH 3.29Å; F206-M235 HydrophobicContact CE2-CE 4.4Å
207	S	97.6	Very high	97.2	Very high	83 Å²	83	46 Å²	46	58%	0.58	26%	0.257	S	S	*	.	S	Bend	trans	-70.6	-35.8	174.9	55.3	0	0	0	0	112	S194	S194-S207 VanDerWaalsContact CB-OG 3.24Å; S194-S207 WeakPolarHBondContact CB-OG 3.5Å; S194-S207 PolarHBondContact O-N 3.46Å; S194-S207 PolarHBondContact O-OG 3.42Å; S194-S207 PolarHBondContact OG-N 2.93Å; S194-S207 PolarHBondContact OG-OG 3.07Å
208	A	96.9	Very high	97.2	Very high	28 Å²	28	46.9 Å²	46.9	23%	0.231	26%	0.26	C	S	.	.	S	Bend	trans	-149.2	117.2	171.1	0	0	0	0	0	109.7	K154 S194 H210	K154-A208 WeakPolarHBondContact O-CA 3.44Å; S194-A208 PolarHBondContact OG-N 3.15Å; S194-A208 PolarHBondContact OG-O 3.36Å; A208-H210 PolarHBondContact O-CE1 3Å; A208-H210 PolarHBondContact O-ND1 2.9Å
209	V	97.2	Very high	97.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.			trans	-73.4	141.2	179.2	-62.5	0	0	0	0	111.9	V150 P151 G153 K154 A156 F206 V237	V150-V209 HydrophobicContact CB-CG2 4.11Å; V150-V209 HydrophobicContact CG1-CG1 4.17Å; V150-V209 HydrophobicContact CG1-CG2 3.61Å; P151-V209 WeakPolarHBondContact O-CG2 3.45Å; G153-V209 PolarHBondContact N-O 3.08Å; K154-V209 WeakPolarHBondContact O-CG2 3.43Å; K154-V209 PolarHBondContact O-N 3.23Å; A156-V209 HydrophobicContact CB-CG1 3.59Å; F206-V209 HydrophobicContact CB-CG1 3.64Å; F206-V209 HydrophobicContact CD1-CG1 4.28Å; F206-V209 HydrophobicContact CD2-CG1 4.48Å; F206-V209 HydrophobicContact CG-CG1 3.9Å; V209-V237 HydrophobicContact CB-CG1 4.19Å; V209-V237 HydrophobicContact CB-CG2 4.21Å; V209-V237 HydrophobicContact CG2-CG1 3.73Å; V209-V237 HydrophobicContact CG2-CG2 4.36Å
210	H	95.9	Very high	97.3	Very high	78 Å²	78	43.4 Å²	43.4	36%	0.361	24%	0.237	S	C	.	.			trans	-111.5	162.9	172.6	-62.6	85.5	0	0	0	110.8	N192 A208 D212 D213 V237	N192-H210 PolarHBondContact O-CE1 3.43Å; N192-H210 PolarHBondContact O-ND1 3.34Å; N192-H210 VanDerWaalsContact O-ND1 3.09Å; A208-H210 PolarHBondContact O-CE1 3Å; A208-H210 PolarHBondContact O-ND1 2.9Å; H210-D212 PolarHBondContact O-N 2.9Å; H210-D213 PolarHBondContact N-OD2 2.94Å; H210-D213 IonicContact ND1-OD2 3.62Å; H210-D213 WeakPolarHBondContact O-CA 3.46Å; H210-D213 VanDerWaalsContact O-CB 3.25Å; H210-D213 WeakPolarHBondContact O-CB 3.45Å; H210-D213 PolarHBondContact O-N 2.9Å; H210-V237 WeakPolarHBondContact O-CG1 3.27Å
211	K	94.9	Very high	97.5	Very high	125 Å²	125	37 Å²	37	54%	0.543	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-57.2	-37.6	-178.7	-161.2	163.4	-166.8	151	0	112.9	D213 S214 D239	K211-D213 PolarHBondContact O-N 3.47Å; K211-S214 WeakPolarHBondContact O-CB 3.5Å; K211-S214 PolarHBondContact O-N 2.85Å; K211-S214 VanDerWaalsContact O-N 3.12Å; K211-S214 PolarHBondContact O-OG 2.77Å; K211-D239 IonicContact NZ-OD2 2.9Å; K211-D239 PolarHBondContact NZ-OD2 3.29Å
212	D	94	Very high	97.6	Very high	112 Å²	112	35.6 Å²	35.6	60%	0.599	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-69.8	-6.9	176.5	-60.4	-24.1	0	0	0	113.7	R175 H210 S214	R175-D212 PolarHBondContact NH2-O 2.85Å; H210-D212 PolarHBondContact O-N 2.9Å; D212-S214 VanDerWaalsContact C-N 3.27Å
213	D	96.8	Very high	97.6	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.011	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-82.8	-3.1	170.9	-60.4	-42.6	0	0	0	113.2	R175 S193 F206 H210 K211 Y217 M235 V237	R175-D213 IonicContact CZ-OD1 3.12Å; R175-D213 IonicContact NH1-OD1 3.97Å; R175-D213 PolarHBondContact NH1-OD1 2.97Å; R175-D213 IonicContact NH2-OD1 2.82Å; S193-D213 VanDerWaalsContact CB-OD1 3.3Å; S193-D213 WeakPolarHBondContact CB-OD1 3.3Å; S193-D213 VanDerWaalsContact OG-CG 3.27Å; S193-D213 PolarHBondContact OG-OD1 3Å; S193-D213 PolarHBondContact OG-OD2 3.37Å; F206-D213 HydrophobicContact CD1-CB 4.38Å; F206-D213 HydrophobicContact CE1-CB 3.96Å; H210-D213 PolarHBondContact N-OD2 2.94Å; H210-D213 IonicContact ND1-OD2 3.62Å; H210-D213 WeakPolarHBondContact O-CA 3.46Å; H210-D213 VanDerWaalsContact O-CB 3.25Å; H210-D213 WeakPolarHBondContact O-CB 3.45Å; H210-D213 PolarHBondContact O-N 2.9Å; K211-D213 PolarHBondContact O-N 3.47Å; D213-Y217 WeakPolarHBondContact O-CE2 3.49Å; D213-Y217 PolarHBondContact O-OH 3.07Å; D213-M235 HydrophobicContact CB-CE 4.29Å; D213-M235 VanDerWaalsContact O-CE 3.24Å; D213-M235 WeakPolarHBondContact O-CE 3.28Å; D213-V237 HydrophobicContact CB-CG2 4.33Å
214	S	97.6	Very high	97.5	Very high	38 Å²	38	40.8 Å²	40.8	27%	0.266	23%	0.227	S	C	.	.			trans	-67.6	144	172.3	-51.5	0	0	0	0	111.6	K211 D212 M235 V237	K211-S214 WeakPolarHBondContact O-CB 3.5Å; K211-S214 PolarHBondContact O-N 2.85Å; K211-S214 VanDerWaalsContact O-N 3.12Å; K211-S214 PolarHBondContact O-OG 2.77Å; D212-S214 VanDerWaalsContact C-N 3.27Å; S214-M235 VanDerWaalsContact CA-O 3.27Å; S214-M235 WeakPolarHBondContact CA-O 3.48Å; S214-V237 WeakPolarHBondContact OG-CB 3.38Å; S214-V237 PolarHBondContact OG-N 2.94Å
215	G	97.6	Very high	97.4	Very high	16 Å²	16	41.7 Å²	41.7	17%	0.165	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.9	-175.7	174.9	0	0	0	0	0	113.5	N176 Y217 M235	N176-G215 WeakPolarHBondContact OD1-CA 3.2Å; G215-Y217 WeakPolarHBondContact O-CD2 3.47Å; G215-M235 PolarHBondContact N-O 3.45Å; G215-M235 PolarHBondContact O-N 2.83Å
216	Q	98.5	Very high	97.3	Very high	77 Å²	77	40.6 Å²	40.6	36%	0.36	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	122	175.8	-171.1	170.5	83.6	0	0	110	R175 N176 D234	R175-Q216 WeakPolarHBondContact CA-O 3.33Å; N176-Q216 PolarHBondContact N-O 3.07Å; N176-Q216 PolarHBondContact OD1-N 3.31Å; Q216-D234 WeakPolarHBondContact CB-OD1 3.33Å
217	Y	98.7	Very high	97.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	136.9	179.6	-73.6	-99.1	0	0	0	111.1	L158 W173 Y174 R175 L180 L204 F206 D213 G215 G232 Q233 M235	L158-Y217 HydrophobicContact CD2-CD1 3.53Å; L158-Y217 HydrophobicContact CD2-CD2 4.26Å; L158-Y217 HydrophobicContact CD2-CE1 3.98Å; L158-Y217 HydrophobicContact CD2-CG 3.66Å; W173-Y217 HydrophobicContact CE3-CD1 4.42Å; Y174-Y217 WeakPolarHBondContact O-CA 3.42Å; R175-Y217 HydrophobicContact CB-CD1 4.22Å; R175-Y217 HydrophobicContact CB-CE1 3.96Å; R175-Y217 WeakPolarHBondContact CD-OH 3.39Å; R175-Y217 HydrophobicContact CG-CD1 4.47Å; R175-Y217 HydrophobicContact CG-CD2 4.47Å; R175-Y217 HydrophobicContact CG-CE1 4.02Å; R175-Y217 HydrophobicContact CG-CE2 3.97Å; R175-Y217 PolarHBondContact NH1-OH 2.91Å; L180-Y217 HydrophobicContact CD1-CD1 4.46Å; L180-Y217 HydrophobicContact CD1-CE1 4.03Å; L204-Y217 HydrophobicContact CD2-CD1 3.95Å; L204-Y217 HydrophobicContact CD2-CE1 3.84Å; F206-Y217 HydrophobicContact CE2-CE1 4.41Å; F206-Y217 HydrophobicContact CZ-CE1 4Å; F206-Y217 AromaticContact CZ-CZ 4Å; F206-Y217 VanDerWaalsContact CZ-OH 3.26Å; F206-Y217 WeakPolarHBondContact CZ-OH 3.29Å; D213-Y217 WeakPolarHBondContact O-CE2 3.49Å; D213-Y217 PolarHBondContact O-OH 3.07Å; G215-Y217 WeakPolarHBondContact O-CD2 3.47Å; Y217-G232 WeakPolarHBondContact O-CA 3.38Å; Y217-Q233 PolarHBondContact N-O 3.33Å; Y217-Q233 PolarHBondContact O-N 2.9Å; Y217-M235 HydrophobicContact CD2-CB 3.99Å; Y217-M235 HydrophobicContact CE2-CB 3.98Å; Y217-M235 HydrophobicContact CE2-CE 3.69Å; Y217-M235 WeakPolarHBondContact OH-CE 3.39Å
218	Y	98.6	Very high	97.3	Very high	26 Å²	26	39.7 Å²	39.7	10%	0.102	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	162.7	166	65.5	-89.9	0	0	0	109.9	Y174 D177 I220	Y174-Y218 VanDerWaalsContact CB-CE1 3.49Å; Y174-Y218 WeakPolarHBondContact CB-OH 3.27Å; Y174-Y218 HydrophobicContact CD1-CE2 4.13Å; Y174-Y218 AromaticContact CD1-CZ 3.79Å; Y174-Y218 WeakPolarHBondContact CD1-OH 3.24Å; Y174-Y218 HydrophobicContact CD2-CD2 4.2Å; Y174-Y218 AromaticContact CD2-CE2 3.59Å; Y174-Y218 HydrophobicContact CD2-CE2 3.59Å; Y174-Y218 HydrophobicContact CE2-CE2 4.37Å; Y174-Y218 HydrophobicContact CG-CD2 4.27Å; Y174-Y218 HydrophobicContact CG-CE1 4.22Å; Y174-Y218 AromaticContact CG-CE2 3.47Å; Y174-Y218 HydrophobicContact CG-CE2 3.47Å; Y174-Y218 VanDerWaalsContact CG-CE2 3.47Å; Y174-Y218 AromaticContact CG-CZ 3.43Å; Y174-Y218 VanDerWaalsContact CG-CZ 3.43Å; Y174-Y218 PolarHBondContact N-O 3.24Å; Y174-Y218 PolarHBondContact O-N 3.33Å; D177-Y218 WeakPolarHBondContact OD1-CE1 3.35Å; Y218-I220 HydrophobicContact CD2-CG1 4.23Å; Y218-I220 HydrophobicContact CE2-CD1 4.17Å; Y218-I220 HydrophobicContact CE2-CG1 4.04Å
219	C	98.4	Very high	97.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.9	178.8	162.1	0	0	0	0	109.9	C160 S172 W173 R229 C230	C160-C219 HydrophobicContact CB-CB 3.52Å; C160-C219 WeakPolarHBondContact CB-SG 3.26Å; C160-C219 WeakPolarHBondContact SG-CB 3.1Å; C160-C219 CovalentContact SG-SG 2.04Å; C160-C219 PolarHBondContact SG-SG 2.89Å; S172-C219 CarbonylContact O-C 3.5Å; S172-C219 VanDerWaalsContact O-CA 3.27Å; S172-C219 WeakPolarHBondContact O-CA 3.4Å; W173-C219 HydrophobicContact CD2-CB 3.86Å; W173-C219 HydrophobicContact CE3-CB 3.89Å; W173-C219 HydrophobicContact CG-CB 4.47Å; W173-C219 HydrophobicContact CH2-CB 4.12Å; W173-C219 HydrophobicContact CZ2-CB 4.1Å; W173-C219 HydrophobicContact CZ3-CB 4.01Å; C219-R229 VanDerWaalsContact O-CA 3.32Å; C219-R229 WeakPolarHBondContact O-CA 3.28Å; C219-C230 PolarHBondContact N-SG 3.5Å; C219-C230 PolarHBondContact O-N 3.44Å; C219-C230 VanDerWaalsContact O-N 3.08Å
220	I	98.5	Very high	97.4	Very high	35 Å²	35	44.5 Å²	44.5	18%	0.179	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.7	172.6	-52.2	-174.1	0	0	0	107.9	Y171 S172 Y174 Y218 A227 S228 R229	Y171-I220 WeakPolarHBondContact CA-O 3.47Å; S172-I220 PolarHBondContact N-O 3.39Å; S172-I220 PolarHBondContact O-N 2.83Å; S172-I220 PolarHBondContact OG-O 2.9Å; Y174-I220 HydrophobicContact CD2-CD1 4.1Å; Y174-I220 HydrophobicContact CD2-CG1 4.06Å; Y174-I220 HydrophobicContact CE2-CB 4.45Å; Y174-I220 HydrophobicContact CE2-CD1 3.47Å; Y174-I220 VanDerWaalsContact CE2-CD1 3.47Å; Y174-I220 HydrophobicContact CE2-CG1 3.76Å; Y218-I220 HydrophobicContact CD2-CG1 4.23Å; Y218-I220 HydrophobicContact CE2-CD1 4.17Å; Y218-I220 HydrophobicContact CE2-CG1 4.04Å; I220-A227 HydrophobicContact CG2-CB 3.95Å; I220-S228 CarbonylContact C-O 3.57Å; I220-S228 WeakPolarHBondContact CA-O 3.46Å; I220-S228 WeakPolarHBondContact CG2-O 3.5Å; I220-R229 HydrophobicContact CG1-CB 3.92Å
221	A	98.6	Very high	97.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.3	168.4	0	0	0	0	0	108.7	P139 P142 E162 P169 H170 Y171 A227 S228	P139-A221 HydrophobicContact CB-CB 4.21Å; P142-A221 HydrophobicContact CB-CB 4.18Å; P142-A221 HydrophobicContact CG-CB 4.11Å; E162-A221 HydrophobicContact CB-CB 4Å; E162-A221 HydrophobicContact CG-CB 4.2Å; P169-A221 HydrophobicContact CB-CB 4.12Å; P169-A221 HydrophobicContact CG-CB 4.36Å; H170-A221 CarbonylContact O-C 3.51Å; H170-A221 WeakPolarHBondContact O-CA 3.47Å; Y171-A221 HydrophobicContact CD1-CB 3.89Å; Y171-A221 HydrophobicContact CE1-CB 3.76Å; A221-A227 VanDerWaalsContact O-CA 3.24Å; A221-A227 WeakPolarHBondContact O-CA 3.43Å; A221-S228 PolarHBondContact N-O 2.97Å; A221-S228 PolarHBondContact O-N 2.93Å
222	S	98.1	Very high	97.6	Very high	42 Å²	42	42.3 Å²	42.3	29%	0.294	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	137.7	-174.7	59.7	0	0	0	0	112.6	P169 H170 G226	P169-S222 CarbonylContact C-O 3.58Å; P169-S222 VanDerWaalsContact CA-O 3.28Å; P169-S222 WeakPolarHBondContact CA-O 3.25Å; H170-S222 PolarHBondContact N-O 3.34Å; H170-S222 PolarHBondContact O-N 2.91Å; H170-S222 PolarHBondContact O-OG 3.2Å; S222-G226 WeakPolarHBondContact CA-O 3.18Å
223	N	97.5	Very high	97.8	Very high	23 Å²	23	40.1 Å²	40.1	12%	0.123	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	-173	167.8	70.3	10.8	0	0	0	110.1	V137 P139 Y166 P167 P169 A225 G226	V137-N223 PolarHBondContact O-ND2 2.84Å; P139-N223 WeakPolarHBondContact CD-OD1 3.35Å; P139-N223 HydrophobicContact CG-CB 4.32Å; Y166-N223 VanDerWaalsContact C-ND2 3.31Å; Y166-N223 PolarHBondContact N-ND2 2.91Å; Y166-N223 PolarHBondContact O-ND2 3.46Å; P167-N223 VanDerWaalsContact O-CB 3.23Å; P167-N223 WeakPolarHBondContact O-CB 3.37Å; P167-N223 PolarHBondContact O-ND2 3.43Å; P169-N223 HydrophobicContact CB-CB 4.49Å; N223-A225 PolarHBondContact O-N 3.45Å; N223-A225 WeakPolarHBondContact OD1-CA 3.38Å; N223-A225 WeakPolarHBondContact OD1-CB 3.33Å; N223-A225 PolarHBondContact OD1-N 2.93Å; N223-G226 PolarHBondContact N-O 3.45Å; N223-G226 PolarHBondContact O-N 2.83Å; N223-G226 VanDerWaalsContact O-O 3.09Å; N223-G226 PolarHBondContact OD1-N 3.27Å; N223-G226 PolarHBondContact OD1-O 3.21Å
224	D	96.2	Very high	97.9	Very high	125 Å²	125	45 Å²	45	67%	0.668	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.2	-178.5	-61.5	-32.6	0	0	0	114
225	A	96.3	Very high	97.9	Very high	18 Å²	18	43.3 Å²	43.3	15%	0.149	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-11.9	177	0	0	0	0	0	113.5	Q136 K138 N223	Q136-A225 HydrophobicContact CB-CB 3.77Å; K138-A225 HydrophobicContact CB-CB 4.25Å; N223-A225 PolarHBondContact O-N 3.45Å; N223-A225 WeakPolarHBondContact OD1-CA 3.38Å; N223-A225 WeakPolarHBondContact OD1-CB 3.33Å; N223-A225 PolarHBondContact OD1-N 2.93Å
226	G	96.8	Very high	97.9	Very high	25 Å²	25	48.7 Å²	48.7	26%	0.258	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	140.1	-159.3	173.3	0	0	0	0	0	113.7	P139 S222 N223	P139-G226 WeakPolarHBondContact CD-O 3.31Å; S222-G226 WeakPolarHBondContact CA-O 3.18Å; N223-G226 PolarHBondContact N-O 3.45Å; N223-G226 PolarHBondContact O-N 2.83Å; N223-G226 VanDerWaalsContact O-O 3.09Å; N223-G226 PolarHBondContact OD1-N 3.27Å; N223-G226 PolarHBondContact OD1-O 3.21Å
227	A	97.8	Very high	97.9	Very high	45 Å²	45	45.2 Å²	45.2	37%	0.372	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	155.1	-173.5	0	0	0	0	0	113.7	K138 I220 A221	K138-A227 WeakPolarHBondContact CE-O 3.19Å; K138-A227 PolarHBondContact NZ-O 3.02Å; I220-A227 HydrophobicContact CG2-CB 3.95Å; A221-A227 VanDerWaalsContact O-CA 3.24Å; A221-A227 WeakPolarHBondContact O-CA 3.43Å
228	S	98.3	Very high	97.7	Very high	18 Å²	18	49.9 Å²	49.9	13%	0.126	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	153.2	174.6	60	0	0	0	0	109.4	P139 V140 P142 I220 A221	P139-S228 VanDerWaalsContact O-CB 3.3Å; P139-S228 WeakPolarHBondContact O-CB 3.41Å; P139-S228 PolarHBondContact O-OG 3.22Å; V140-S228 VanDerWaalsContact C-OG 3.28Å; V140-S228 WeakPolarHBondContact O-CB 3.5Å; V140-S228 PolarHBondContact O-OG 3.47Å; P142-S228 WeakPolarHBondContact CD-OG 3.46Å; I220-S228 CarbonylContact C-O 3.57Å; I220-S228 WeakPolarHBondContact CA-O 3.46Å; I220-S228 WeakPolarHBondContact CG2-O 3.5Å; A221-S228 PolarHBondContact N-O 2.97Å; A221-S228 PolarHBondContact O-N 2.93Å
229	R	97.8	Very high	97.4	Very high	126 Å²	126	52.9 Å²	52.9	48%	0.475	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	147.3	179.4	72.2	170.8	-176.2	76.5	0.4	110.9	T141 C219 I220 E231	T141-R229 WeakPolarHBondContact CG2-O 3.28Å; C219-R229 VanDerWaalsContact O-CA 3.32Å; C219-R229 WeakPolarHBondContact O-CA 3.28Å; I220-R229 HydrophobicContact CG1-CB 3.92Å; R229-E231 IonicContact NH1-OE2 3.56Å
230	C	98.1	Very high	96.9	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.02	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-78	167.4	168.5	64.8	0	0	0	0	111.2	P142 C144 C219	P142-C230 HydrophobicContact CG-CB 4.09Å; P142-C230 VanDerWaalsContact O-CB 3.25Å; P142-C230 WeakPolarHBondContact O-CB 3.42Å; C144-C230 HydrophobicContact CB-CB 3.67Å; C144-C230 WeakPolarHBondContact CB-SG 3.48Å; C144-C230 WeakPolarHBondContact SG-CB 3.33Å; C144-C230 CovalentContact SG-SG 2.02Å; C144-C230 PolarHBondContact SG-SG 3.47Å; C219-C230 PolarHBondContact N-SG 3.5Å; C219-C230 PolarHBondContact O-N 3.44Å; C219-C230 VanDerWaalsContact O-N 3.08Å
231	E	97.7	Very high	96.4	Very high	132 Å²	132	61.1 Å²	61.1	62%	0.617	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-69.7	148.8	169.7	-64.4	-53.6	147.7	0	0	111.6	R229	R229-E231 IonicContact NH1-OE2 3.56Å
232	G	98	Very high	95.9	Very high	26 Å²	26	66.4 Å²	66.4	27%	0.268	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-63.9	133.8	176.7	0	0	0	0	0	111.9	Y217	Y217-G232 WeakPolarHBondContact O-CA 3.38Å
233	Q	98.6	Very high	95.5	Very high	65 Å²	65	68.3 Å²	68.3	30%	0.304	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.2	175.8	-64.9	177.9	26.2	0	0	109.6	C144 V146 Y217	C144-Q233 PolarHBondContact O-NE2 2.84Å; V146-Q233 HydrophobicContact CB-CB 3.68Å; V146-Q233 HydrophobicContact CG1-CB 4.31Å; V146-Q233 HydrophobicContact CG2-CB 3.86Å; Y217-Q233 PolarHBondContact N-O 3.33Å; Y217-Q233 PolarHBondContact O-N 2.9Å
234	D	98.4	Very high	95.1	Very high	105 Å²	105	69.4 Å²	69.4	56%	0.561	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	133.7	-179.7	-60.3	-51.1	0	0	0	111.4	Q216	Q216-D234 WeakPolarHBondContact CB-OD1 3.33Å
235	M	98.3	Very high	94.9	Very high	3 Å²	3	68.1 Å²	68.1	2%	0.015	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.8	167.8	-177.1	176.4	78.1	0	0	109.2	V146 P147 V150 L158 F206 D213 S214 G215 Y217 V237	V146-M235 HydrophobicContact CG1-CB 3.81Å; P147-M235 WeakPolarHBondContact O-CB 3.45Å; P147-M235 WeakPolarHBondContact O-CG 3.35Å; V150-M235 HydrophobicContact CG2-CG 4.3Å; V150-M235 HydrophobicContact CG2-SD 4.05Å; L158-M235 HydrophobicContact CD1-SD 4.01Å; F206-M235 HydrophobicContact CE2-CE 4.4Å; D213-M235 HydrophobicContact CB-CE 4.29Å; D213-M235 VanDerWaalsContact O-CE 3.24Å; D213-M235 WeakPolarHBondContact O-CE 3.28Å; S214-M235 VanDerWaalsContact CA-O 3.27Å; S214-M235 WeakPolarHBondContact CA-O 3.48Å; G215-M235 PolarHBondContact N-O 3.45Å; G215-M235 PolarHBondContact O-N 2.83Å; Y217-M235 HydrophobicContact CD2-CB 3.99Å; Y217-M235 HydrophobicContact CE2-CB 3.98Å; Y217-M235 HydrophobicContact CE2-CE 3.69Å; Y217-M235 WeakPolarHBondContact OH-CE 3.39Å; M235-V237 HydrophobicContact CE-CG2 4.13Å
236	E	97.9	Very high	94.8	Very high	128 Å²	128	72.3 Å²	72.3	60%	0.598	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.9	174.3	-172.9	177.6	-177.3	0	0	111	K148 A149 V150	K148-E236 PolarHBondContact O-N 3.34Å; A149-E236 CarbonylContact C-O 3.58Å; A149-E236 WeakPolarHBondContact CA-O 3.37Å; V150-E236 PolarHBondContact N-O 2.85Å
237	V	97.4	Very high	94.7	Very high	5 Å²	5	72.6 Å²	72.6	3%	0.03	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117.2	174	-174.9	0	0	0	0	110.1	V150 V152 V209 H210 D213 S214 M235	V150-V237 VanDerWaalsContact O-CA 3.27Å; V150-V237 WeakPolarHBondContact O-CA 3.39Å; V152-V237 HydrophobicContact CB-CG1 4.42Å; V152-V237 HydrophobicContact CG2-CG1 3.57Å; V209-V237 HydrophobicContact CB-CG1 4.19Å; V209-V237 HydrophobicContact CB-CG2 4.21Å; V209-V237 HydrophobicContact CG2-CG1 3.73Å; V209-V237 HydrophobicContact CG2-CG2 4.36Å; H210-V237 WeakPolarHBondContact O-CG1 3.27Å; D213-V237 HydrophobicContact CB-CG2 4.33Å; S214-V237 WeakPolarHBondContact OG-CB 3.38Å; S214-V237 PolarHBondContact OG-N 2.94Å; M235-V237 HydrophobicContact CE-CG2 4.13Å
238	Y	95.1	Very high	94.6	Very high	98 Å²	98	72.3 Å²	72.3	38%	0.384	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	151	-172.8	69.5	-86.6	0	0	0	113.4	A149 V150 P151 V152 L240	A149-Y238 HydrophobicContact CB-CD1 3.96Å; A149-Y238 HydrophobicContact CB-CE1 3.83Å; V150-Y238 WeakPolarHBondContact O-CD1 3.43Å; V150-Y238 PolarHBondContact O-N 3.35Å; P151-Y238 CarbonylContact C-O 3.54Å; P151-Y238 VanDerWaalsContact CA-O 3.25Å; P151-Y238 WeakPolarHBondContact CA-O 3.48Å; P151-Y238 HydrophobicContact CB-CE1 4.47Å; P151-Y238 HydrophobicContact CB-CE2 4.21Å; P151-Y238 HydrophobicContact CG-CE1 4.12Å; P151-Y238 HydrophobicContact CG-CE2 4.22Å; V152-Y238 PolarHBondContact N-O 2.89Å; Y238-L240 HydrophobicContact CE2-CD2 3.98Å
239	D	92.8	Very high	94.6	Very high	88 Å²	88	75.3 Å²	75.3	47%	0.471	42%	0.42	S	S	.	.			trans	-81	137.1	176.8	-63.9	-61.8	0	0	0	110.5	V152 K211 N241	V152-D239 WeakPolarHBondContact CG2-OD1 3.25Å; K211-D239 IonicContact NZ-OD2 2.9Å; K211-D239 PolarHBondContact NZ-OD2 3.29Å; D239-N241 PolarHBondContact O-N 3.07Å
240	L	87.8	Confident	94.6	Very high	79 Å²	79	74 Å²	74	41%	0.414	42%	0.422	S	S	.	.			trans	-75.5	123.3	171.4	-71.3	172.5	0	0	0	109.5	P151 Y238 I242	P151-L240 HydrophobicContact CB-CD1 4.09Å; P151-L240 HydrophobicContact CB-CD2 4Å; P151-L240 HydrophobicContact CB-CG 3.8Å; P151-L240 HydrophobicContact CG-CD2 4.28Å; Y238-L240 HydrophobicContact CE2-CD2 3.98Å; L240-I242 HydrophobicContact CB-CG1 4.48Å; L240-I242 PolarHBondContact O-N 3.31Å
241	N	88.2	Confident	94.6	Very high	130 Å²	130	78.1 Å²	78.1	70%	0.695	45%	0.447	S	S	*	.			trans	-77.1	71.7	179.3	-123.8	36.5	0	0	0	111.1	D239 A243 G244 I245	D239-N241 PolarHBondContact O-N 3.07Å; N241-A243 VanDerWaalsContact C-N 3.26Å; N241-A243 PolarHBondContact O-N 2.89Å; N241-G244 WeakPolarHBondContact O-CA 3.48Å; N241-G244 PolarHBondContact O-N 3.12Å; N241-I245 PolarHBondContact O-N 3.21Å
242	I	87.9	Confident	94.5	Very high	111 Å²	111	75.9 Å²	75.9	57%	0.569	44%	0.442	S	S	*	.	H	α-helix	trans	-53.9	-43.1	-174.3	-66.3	174.9	0	0	0	111.3	L240 G244 I245 I246	L240-I242 HydrophobicContact CB-CG1 4.48Å; L240-I242 PolarHBondContact O-N 3.31Å; I242-G244 VanDerWaalsContact C-N 3.31Å; I242-G244 PolarHBondContact O-N 2.89Å; I242-I245 PolarHBondContact O-N 2.77Å; I242-I246 HydrophobicContact CG2-CD1 3.51Å; I242-I246 HydrophobicContact CG2-CG1 4.15Å; I242-I246 WeakPolarHBondContact O-CB 3.11Å; I242-I246 VanDerWaalsContact O-CG1 3.28Å; I242-I246 WeakPolarHBondContact O-CG1 3.48Å; I242-I246 PolarHBondContact O-N 2.96Å
243	A	88.8	Confident	94.5	Very high	82 Å²	82	79.5 Å²	79.5	68%	0.678	45%	0.454	S	S	*	.	H	α-helix	trans	-61.4	-38.4	177.7	0	0	0	0	0	112.7	N241 G247	N241-A243 VanDerWaalsContact C-N 3.26Å; N241-A243 PolarHBondContact O-N 2.89Å; A243-G247 PolarHBondContact O-N 3.22Å
244	G	90.1	Very high	94.5	Very high	45 Å²	45	80.8 Å²	80.8	46%	0.464	46%	0.463	S	S	.	.	H	α-helix	trans	-68.3	-41.2	176.1	0	0	0	0	0	112.3	N241 I242 G248	N241-G244 WeakPolarHBondContact O-CA 3.48Å; N241-G244 PolarHBondContact O-N 3.12Å; I242-G244 VanDerWaalsContact C-N 3.31Å; I242-G244 PolarHBondContact O-N 2.89Å; G244-G248 PolarHBondContact O-N 3.24Å
245	I	91.8	Very high	94.5	Very high	99 Å²	99	79.4 Å²	79.4	51%	0.508	46%	0.458	S	S	.	.	H	α-helix	trans	-63.8	-49.8	176.3	-60.6	173.1	0	0	0	110.1	N241 I242 G247 G248 V249	N241-I245 PolarHBondContact O-N 3.21Å; I242-I245 PolarHBondContact O-N 2.77Å; I245-G247 PolarHBondContact O-N 2.86Å; I245-G248 PolarHBondContact O-N 3.02Å; I245-V249 VanDerWaalsContact O-CG2 3.31Å; I245-V249 WeakPolarHBondContact O-CG2 3.47Å; I245-V249 PolarHBondContact O-N 2.88Å
246	I	94.1	Very high	94.4	Very high	106 Å²	106	83.8 Å²	83.8	54%	0.544	48%	0.481	S	S	.	.	H	α-helix	trans	-61.6	-45.8	178.7	-66.6	171.9	0	0	0	110.5	I242 G248 V249 L250	I242-I246 HydrophobicContact CG2-CD1 3.51Å; I242-I246 HydrophobicContact CG2-CG1 4.15Å; I242-I246 WeakPolarHBondContact O-CB 3.11Å; I242-I246 VanDerWaalsContact O-CG1 3.28Å; I242-I246 WeakPolarHBondContact O-CG1 3.48Å; I242-I246 PolarHBondContact O-N 2.96Å; I246-G248 PolarHBondContact O-N 3.44Å; I246-V249 PolarHBondContact O-N 2.87Å; I246-L250 WeakPolarHBondContact O-CB 3.5Å; I246-L250 PolarHBondContact O-N 3.3Å
247	G	95	Very high	94.4	Very high	31 Å²	31	80 Å²	80	32%	0.32	47%	0.471	S	S	.	.	H	α-helix	trans	-60.1	-45.5	177.2	0	0	0	0	0	112.3	A243 I245 L250 V251	A243-G247 PolarHBondContact O-N 3.22Å; I245-G247 PolarHBondContact O-N 2.86Å; G247-L250 PolarHBondContact O-N 2.6Å; G247-V251 WeakPolarHBondContact O-CG2 3.42Å; G247-V251 PolarHBondContact O-N 2.97Å
248	G	95.3	Very high	94.4	Very high	38 Å²	38	84.3 Å²	84.3	39%	0.392	50%	0.498	S	S	.	.	H	α-helix	trans	-61.1	-46.2	176.4	0	0	0	0	0	112.6	G244 I245 I246 L250 V251 V252	G244-G248 PolarHBondContact O-N 3.24Å; I245-G248 PolarHBondContact O-N 3.02Å; I246-G248 PolarHBondContact O-N 3.44Å; G248-L250 VanDerWaalsContact C-N 3.35Å; G248-L250 PolarHBondContact O-N 2.82Å; G248-V251 PolarHBondContact O-N 3.3Å; G248-V252 WeakPolarHBondContact O-CG2 3.25Å; G248-V252 PolarHBondContact O-N 3.27Å
249	V	97.1	Very high	94.4	Very high	81 Å²	81	84 Å²	84	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-43.4	176.5	172.4	0	0	0	0	111.1	I245 I246 V251 V252 L253	I245-V249 VanDerWaalsContact O-CG2 3.31Å; I245-V249 WeakPolarHBondContact O-CG2 3.47Å; I245-V249 PolarHBondContact O-N 2.88Å; I246-V249 PolarHBondContact O-N 2.87Å; V249-V251 VanDerWaalsContact C-N 3.35Å; V249-V251 PolarHBondContact O-N 3.26Å; V249-V252 PolarHBondContact O-N 3.32Å; V249-L253 HydrophobicContact CG1-CD1 4.07Å; V249-L253 HydrophobicContact CG1-CG 4.39Å; V249-L253 WeakPolarHBondContact O-CG 3.3Å; V249-L253 PolarHBondContact O-N 3.01Å
250	L	97.6	Very high	94.6	Very high	99 Å²	99	83.5 Å²	83.5	52%	0.518	50%	0.502	S	S	.	.	H	α-helix	trans	-61	-43.4	178.2	-177.7	64	0	0	0	111.8	I246 G247 G248 L253 I254	I246-L250 WeakPolarHBondContact O-CB 3.5Å; I246-L250 PolarHBondContact O-N 3.3Å; G247-L250 PolarHBondContact O-N 2.6Å; G248-L250 VanDerWaalsContact C-N 3.35Å; G248-L250 PolarHBondContact O-N 2.82Å; L250-L253 PolarHBondContact O-N 3.47Å; L250-I254 HydrophobicContact CD1-CD1 4.33Å; L250-I254 HydrophobicContact CG-CD1 4Å; L250-I254 VanDerWaalsContact O-CG1 3.28Å; L250-I254 WeakPolarHBondContact O-CG1 3.2Å; L250-I254 PolarHBondContact O-N 3.33Å
251	V	97.7	Very high	94.9	Very high	89 Å²	89	85.8 Å²	85.8	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-45.1	176.7	171.7	0	0	0	0	111	G247 G248 V249 L253 I254 V255	G247-V251 WeakPolarHBondContact O-CG2 3.42Å; G247-V251 PolarHBondContact O-N 2.97Å; G248-V251 PolarHBondContact O-N 3.3Å; V249-V251 VanDerWaalsContact C-N 3.35Å; V249-V251 PolarHBondContact O-N 3.26Å; V251-L253 VanDerWaalsContact C-N 3.34Å; V251-L253 PolarHBondContact O-N 3.44Å; V251-I254 PolarHBondContact O-N 3.05Å; V251-V255 WeakPolarHBondContact O-CG2 3.38Å; V251-V255 PolarHBondContact O-N 2.91Å
252	V	97.6	Very high	95.2	Very high	86 Å²	86	81.5 Å²	81.5	52%	0.521	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-44.1	177.2	172.9	0	0	0	0	111.1	G248 V249 I254 V255 L256	G248-V252 WeakPolarHBondContact O-CG2 3.25Å; G248-V252 PolarHBondContact O-N 3.27Å; V249-V252 PolarHBondContact O-N 3.32Å; V252-I254 PolarHBondContact O-N 3.44Å; V252-V255 PolarHBondContact O-N 3.37Å; V252-L256 HydrophobicContact CG1-CD1 4.07Å; V252-L256 HydrophobicContact CG1-CG 4.47Å; V252-L256 WeakPolarHBondContact O-CG 3.38Å; V252-L256 PolarHBondContact O-N 3.34Å
253	L	97.6	Very high	95.4	Very high	101 Å²	101	80.1 Å²	80.1	53%	0.529	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-40.3	177.4	-69.2	175.5	0	0	0	112.4	V249 L250 V251 L256 A257	V249-L253 HydrophobicContact CG1-CD1 4.07Å; V249-L253 HydrophobicContact CG1-CG 4.39Å; V249-L253 WeakPolarHBondContact O-CG 3.3Å; V249-L253 PolarHBondContact O-N 3.01Å; L250-L253 PolarHBondContact O-N 3.47Å; V251-L253 VanDerWaalsContact C-N 3.34Å; V251-L253 PolarHBondContact O-N 3.44Å; L253-L256 PolarHBondContact O-N 3.49Å; L253-A257 WeakPolarHBondContact O-CB 3.24Å; L253-A257 PolarHBondContact O-N 3.34Å
254	I	97.8	Very high	95.5	Very high	93 Å²	93	79.7 Å²	79.7	48%	0.477	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-45.2	175.8	-69.3	165	0	0	0	110.6	L250 V251 V252 L256 A257 V258	L250-I254 HydrophobicContact CD1-CD1 4.33Å; L250-I254 HydrophobicContact CG-CD1 4Å; L250-I254 VanDerWaalsContact O-CG1 3.28Å; L250-I254 WeakPolarHBondContact O-CG1 3.2Å; L250-I254 PolarHBondContact O-N 3.33Å; V251-I254 PolarHBondContact O-N 3.05Å; V252-I254 PolarHBondContact O-N 3.44Å; I254-L256 PolarHBondContact O-N 2.88Å; I254-A257 WeakPolarHBondContact O-CB 3.48Å; I254-A257 PolarHBondContact O-N 3.15Å; I254-V258 HydrophobicContact CG2-CG2 4.46Å; I254-V258 WeakPolarHBondContact O-CG2 3.35Å; I254-V258 PolarHBondContact O-N 3.48Å
255	V	97.8	Very high	95.4	Very high	76 Å²	76	80.6 Å²	80.6	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-61.3	-44.8	178.3	171.6	0	0	0	0	111	V251 V252 A257 V258 I259	V251-V255 WeakPolarHBondContact O-CG2 3.38Å; V251-V255 PolarHBondContact O-N 2.91Å; V252-V255 PolarHBondContact O-N 3.37Å; V255-A257 VanDerWaalsContact C-N 3.33Å; V255-A257 PolarHBondContact O-N 2.95Å; V255-V258 PolarHBondContact O-N 3.5Å; V255-I259 HydrophobicContact CG1-CD1 3.76Å; V255-I259 HydrophobicContact CG1-CG1 4.43Å; V255-I259 VanDerWaalsContact O-CG1 3.28Å; V255-I259 WeakPolarHBondContact O-CG1 3.21Å; V255-I259 PolarHBondContact O-N 2.65Å
256	L	97.4	Very high	95.2	Very high	94 Å²	94	77.2 Å²	77.2	49%	0.492	47%	0.469	S	S	.	.	H	α-helix	trans	-62.6	-39.6	175.7	-68.9	173.7	0	0	0	112	V252 L253 I254 I259 T260	V252-L256 HydrophobicContact CG1-CD1 4.07Å; V252-L256 HydrophobicContact CG1-CG 4.47Å; V252-L256 WeakPolarHBondContact O-CG 3.38Å; V252-L256 PolarHBondContact O-N 3.34Å; L253-L256 PolarHBondContact O-N 3.49Å; I254-L256 PolarHBondContact O-N 2.88Å; L256-I259 PolarHBondContact O-N 2.92Å; L256-T260 WeakPolarHBondContact O-CB 3.3Å; L256-T260 VanDerWaalsContact O-CG2 3.28Å; L256-T260 WeakPolarHBondContact O-CG2 3.32Å; L256-T260 PolarHBondContact O-N 3.19Å; L256-T260 PolarHBondContact O-OG1 3.24Å
257	A	97.3	Very high	94.7	Very high	49 Å²	49	79.4 Å²	79.4	41%	0.405	47%	0.471	S	S	.	.	H	α-helix	trans	-63.9	-40.8	175.6	0	0	0	0	0	112.1	L253 I254 V255 T260 M261	L253-A257 WeakPolarHBondContact O-CB 3.24Å; L253-A257 PolarHBondContact O-N 3.34Å; I254-A257 WeakPolarHBondContact O-CB 3.48Å; I254-A257 PolarHBondContact O-N 3.15Å; V255-A257 VanDerWaalsContact C-N 3.33Å; V255-A257 PolarHBondContact O-N 2.95Å; A257-T260 WeakPolarHBondContact CA-OG1 3.31Å; A257-T260 PolarHBondContact O-OG1 3.46Å; A257-M261 WeakPolarHBondContact O-CB 3.24Å; A257-M261 PolarHBondContact O-N 2.88Å
258	V	96.8	Very high	94.1	Very high	96 Å²	96	89.1 Å²	89.1	58%	0.582	50%	0.498	S	S	*	.	H	α-helix	trans	-67	-43.1	176.5	172.6	0	0	0	0	111.3	I254 V255 M261 G262	I254-V258 HydrophobicContact CG2-CG2 4.46Å; I254-V258 WeakPolarHBondContact O-CG2 3.35Å; I254-V258 PolarHBondContact O-N 3.48Å; V255-V258 PolarHBondContact O-N 3.5Å; V258-M261 PolarHBondContact O-N 3.27Å; V258-G262 PolarHBondContact O-N 3.23Å
259	I	96.4	Very high	93.3	Very high	90 Å²	90	97.6 Å²	97.6	46%	0.462	52%	0.518	S	S	.	.	H	α-helix	trans	-62.1	-49.4	176.8	-68.4	166.5	0	0	0	110.4	V255 L256 M261 G262 I263	V255-I259 HydrophobicContact CG1-CD1 3.76Å; V255-I259 HydrophobicContact CG1-CG1 4.43Å; V255-I259 VanDerWaalsContact O-CG1 3.28Å; V255-I259 WeakPolarHBondContact O-CG1 3.21Å; V255-I259 PolarHBondContact O-N 2.65Å; L256-I259 PolarHBondContact O-N 2.92Å; I259-M261 PolarHBondContact O-N 3.44Å; I259-G262 PolarHBondContact O-N 2.9Å; I259-I263 HydrophobicContact CG2-CD1 3.78Å; I259-I263 HydrophobicContact CG2-CG1 4.47Å; I259-I263 VanDerWaalsContact O-CG1 3.3Å; I259-I263 WeakPolarHBondContact O-CG1 3.4Å; I259-I263 PolarHBondContact O-N 2.97Å
260	T	95.9	Very high	91.7	Very high	79 Å²	79	96 Å²	96	49%	0.485	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-41	179.4	50.9	0	0	0	0	111.9	L256 A257 I263 C264	L256-T260 WeakPolarHBondContact O-CB 3.3Å; L256-T260 VanDerWaalsContact O-CG2 3.28Å; L256-T260 WeakPolarHBondContact O-CG2 3.32Å; L256-T260 PolarHBondContact O-N 3.19Å; L256-T260 PolarHBondContact O-OG1 3.24Å; A257-T260 WeakPolarHBondContact CA-OG1 3.31Å; A257-T260 PolarHBondContact O-OG1 3.46Å; T260-I263 PolarHBondContact O-N 2.91Å; T260-C264 WeakPolarHBondContact O-CB 3.34Å; T260-C264 PolarHBondContact O-N 2.97Å; T260-C264 PolarHBondContact O-SG 3.32Å
261	M	95.3	Very high	89.9	Confident	126 Å²	126	96 Å²	96	62%	0.621	53%	0.525	S	S	*	.	H	α-helix	trans	-63.5	-42	173.7	-169.7	-174.9	-60.1	0	0	111.9	A257 V258 I259 C264 C265	A257-M261 WeakPolarHBondContact O-CB 3.24Å; A257-M261 PolarHBondContact O-N 2.88Å; V258-M261 PolarHBondContact O-N 3.27Å; I259-M261 PolarHBondContact O-N 3.44Å; M261-C264 PolarHBondContact O-N 3.33Å; M261-C265 WeakPolarHBondContact O-CB 3.34Å; M261-C265 PolarHBondContact O-N 2.67Å; M261-C265 PolarHBondContact O-SG 3.07Å
262	G	93.3	Very high	87.8	Confident	41 Å²	41	98 Å²	98	42%	0.423	53%	0.527	S	S	.	.	H	α-helix	trans	-59.6	-46.1	175.2	0	0	0	0	0	112.3	V258 I259 C265 A266	V258-G262 PolarHBondContact O-N 3.23Å; I259-G262 PolarHBondContact O-N 2.9Å; G262-C265 PolarHBondContact O-N 3.18Å; G262-A266 WeakPolarHBondContact O-CB 3.49Å; G262-A266 PolarHBondContact O-N 3.28Å
263	I	92.8	Very high	85.7	Confident	81 Å²	81	101 Å²	101	42%	0.415	54%	0.539	S	S	.	.	H	α-helix	trans	-61.4	-48.8	175.2	-68.2	167.5	0	0	0	110.7	I259 T260 C265 A266 Y267	I259-I263 HydrophobicContact CG2-CD1 3.78Å; I259-I263 HydrophobicContact CG2-CG1 4.47Å; I259-I263 VanDerWaalsContact O-CG1 3.3Å; I259-I263 WeakPolarHBondContact O-CG1 3.4Å; I259-I263 PolarHBondContact O-N 2.97Å; T260-I263 PolarHBondContact O-N 2.91Å; I263-C265 VanDerWaalsContact C-N 3.31Å; I263-C265 PolarHBondContact O-N 2.9Å; I263-A266 WeakPolarHBondContact O-CB 3.35Å; I263-A266 PolarHBondContact O-N 2.95Å; I263-A266 VanDerWaalsContact O-N 3.15Å; I263-Y267 HydrophobicContact CG2-CD2 3.6Å; I263-Y267 HydrophobicContact CG2-CE2 3.34Å; I263-Y267 WeakPolarHBondContact O-CD2 3.47Å; I263-Y267 PolarHBondContact O-N 2.9Å
264	C	90.3	Very high	83.5	Confident	74 Å²	74	102.9 Å²	102.9	50%	0.5	55%	0.549	S	S	.	.	H	α-helix	trans	-59.2	-40.3	176.9	-76.4	0	0	0	0	112.6	T260 M261 Y267 R268	T260-C264 WeakPolarHBondContact O-CB 3.34Å; T260-C264 PolarHBondContact O-N 2.97Å; T260-C264 PolarHBondContact O-SG 3.32Å; M261-C264 PolarHBondContact O-N 3.33Å; C264-Y267 PolarHBondContact O-N 3.23Å; C264-R268 WeakPolarHBondContact O-CB 3.28Å; C264-R268 PolarHBondContact O-N 2.97Å
265	C	89.7	Confident	81	Confident	63 Å²	63	103.9 Å²	103.9	43%	0.426	57%	0.565	S	S	.	*	H	α-helix	trans	-65.8	-41	175.1	-76.5	0	0	0	0	112	M261 G262 I263 R268 R269	M261-C265 WeakPolarHBondContact O-CB 3.34Å; M261-C265 PolarHBondContact O-N 2.67Å; M261-C265 PolarHBondContact O-SG 3.07Å; G262-C265 PolarHBondContact O-N 3.18Å; I263-C265 VanDerWaalsContact C-N 3.31Å; I263-C265 PolarHBondContact O-N 2.9Å; C265-R268 PolarHBondContact O-N 3.26Å; C265-R269 WeakPolarHBondContact O-CB 3.28Å; C265-R269 WeakPolarHBondContact O-CG 3.48Å; C265-R269 PolarHBondContact O-N 3.02Å
266	A	86.5	Confident	78.3	Confident	29 Å²	29	105.6 Å²	105.6	24%	0.24	58%	0.575	C	S	.	*	H	α-helix	trans	-63.5	-40.5	175.5	0	0	0	0	0	112	G262 I263 G270 C271 F272	G262-A266 WeakPolarHBondContact O-CB 3.49Å; G262-A266 PolarHBondContact O-N 3.28Å; I263-A266 WeakPolarHBondContact O-CB 3.35Å; I263-A266 PolarHBondContact O-N 2.95Å; I263-A266 VanDerWaalsContact O-N 3.15Å; A266-G270 PolarHBondContact O-N 3.38Å; A266-C271 PolarHBondContact O-N 3.4Å; A266-C271 VanDerWaalsContact O-N 3.13Å; A266-F272 HydrophobicContact CB-CD2 4.45Å; A266-F272 HydrophobicContact CB-CE2 4.31Å
267	Y	82.9	Confident	75.5	Confident	152 Å²	152	110 Å²	110	60%	0.596	59%	0.593	S	S	*	*	H	α-helix	trans	-63	-46	172.2	-80.6	-64	0	0	0	112.1	I263 C264 R269 G270 F272	I263-Y267 HydrophobicContact CG2-CD2 3.6Å; I263-Y267 HydrophobicContact CG2-CE2 3.34Å; I263-Y267 WeakPolarHBondContact O-CD2 3.47Å; I263-Y267 PolarHBondContact O-N 2.9Å; C264-Y267 PolarHBondContact O-N 3.23Å; Y267-R269 PolarHBondContact O-N 3Å; Y267-G270 PolarHBondContact O-N 2.86Å; Y267-F272 HydrophobicContact CD1-CB 4.34Å; Y267-F272 HydrophobicContact CD1-CD2 4.21Å; Y267-F272 HydrophobicContact CD1-CG 4.47Å; Y267-F272 HydrophobicContact CE1-CB 4.28Å; Y267-F272 HydrophobicContact CE1-CD2 4.09Å; Y267-F272 HydrophobicContact CE1-CG 4.15Å
268	R	82.7	Confident	72.8	Confident	234 Å²	234	115 Å²	115	88%	0.883	61%	0.613	S	S	*	*	H	α-helix	trans	-68.7	-32	179.9	-79.5	-169.7	176.3	-169	0.4	114.1	C264 C265 G270	C264-R268 WeakPolarHBondContact O-CB 3.28Å; C264-R268 PolarHBondContact O-N 2.97Å; C265-R268 PolarHBondContact O-N 3.26Å; R268-G270 VanDerWaalsContact C-N 3.3Å
269	R	79.6	Confident	69.9	Low	216 Å²	216	114.1 Å²	114.1	82%	0.815	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	6.7	178.7	-70.3	-172.9	177.9	-173.4	0.4	113.7	C265 Y267 C271	C265-R269 WeakPolarHBondContact O-CB 3.28Å; C265-R269 WeakPolarHBondContact O-CG 3.48Å; C265-R269 PolarHBondContact O-N 3.02Å; Y267-R269 PolarHBondContact O-N 3Å; R269-C271 VanDerWaalsContact C-N 3.35Å; R269-C271 PolarHBondContact O-N 3.09Å
270	G	62.1	Low	67.2	Low	47 Å²	47	118.3 Å²	118.3	49%	0.485	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	72	22	172.9	0	0	0	0	0	115.1	A266 Y267 R268 F272	A266-G270 PolarHBondContact O-N 3.38Å; Y267-G270 PolarHBondContact O-N 2.86Å; R268-G270 VanDerWaalsContact C-N 3.3Å; G270-F272 VanDerWaalsContact C-N 3.28Å; G270-F272 PolarHBondContact O-N 3.12Å
271	C	59.5	Low	64.7	Low	100 Å²	100	120 Å²	120	68%	0.676	66%	0.656	S	S	*	*			trans	-78.1	-11.7	178.5	-70	0	0	0	0	113.5	A266 R269 I273	A266-C271 PolarHBondContact O-N 3.4Å; A266-C271 VanDerWaalsContact O-N 3.13Å; R269-C271 VanDerWaalsContact C-N 3.35Å; R269-C271 PolarHBondContact O-N 3.09Å; C271-I273 PolarHBondContact O-N 3.19Å
272	F	55.4	Low	61.9	Low	131 Å²	131	124.1 Å²	124.1	58%	0.575	67%	0.666	S	S	*	*			trans	-95.7	81.5	164.9	-80.2	-85.7	0	0	0	108.7	A266 Y267 G270 N274	A266-F272 HydrophobicContact CB-CD2 4.45Å; A266-F272 HydrophobicContact CB-CE2 4.31Å; Y267-F272 HydrophobicContact CD1-CB 4.34Å; Y267-F272 HydrophobicContact CD1-CD2 4.21Å; Y267-F272 HydrophobicContact CD1-CG 4.47Å; Y267-F272 HydrophobicContact CE1-CB 4.28Å; Y267-F272 HydrophobicContact CE1-CD2 4.09Å; Y267-F272 HydrophobicContact CE1-CG 4.15Å; G270-F272 VanDerWaalsContact C-N 3.28Å; G270-F272 PolarHBondContact O-N 3.12Å; F272-N274 PolarHBondContact O-N 3.29Å
273	I	52	Low	59.1	Low	150 Å²	150	131.6 Å²	131.6	77%	0.769	69%	0.687	S	S	*	*			trans	-64.5	110.8	160.9	-64.2	168.8	0	0	0	105.6	C271 S275	C271-I273 PolarHBondContact O-N 3.19Å; I273-S275 PolarHBondContact O-N 2.92Å; I273-S275 VanDerWaalsContact O-N 3.07Å
274	N	52.2	Low	56.6	Low	139 Å²	139	133.2 Å²	133.2	74%	0.743	71%	0.706	S	S	*	*			trans	-59.5	111.5	159.5	-86.5	-8.3	0	0	0	106.4	F272 T276	F272-N274 PolarHBondContact O-N 3.29Å; N274-T276 PolarHBondContact O-N 3.32Å
275	S	44.7	Very low	54.6	Low	115 Å²	115	136 Å²	136	80%	0.804	72%	0.723	S	S	*	*			trans	-70.6	77.7	159.3	59.1	0	0	0	0	107.6	I273 Q277	I273-S275 PolarHBondContact O-N 2.92Å; I273-S275 VanDerWaalsContact O-N 3.07Å; S275-Q277 PolarHBondContact O-N 3.47Å
276	T	40.8	Very low	51.9	Low	111 Å²	111	136.7 Å²	136.7	68%	0.681	74%	0.74	S	S	*	*			trans	-73.9	101.3	158.6	-37.4	0	0	0	0	105.2	N274 D278	N274-T276 PolarHBondContact O-N 3.32Å; T276-D278 PolarHBondContact O-N 2.85Å
277	Q	38.3	Very low	49.7	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	77%	0.768	S	S	*	*			trans	-74.2	108.9	170.7	-145.2	174.3	13.5	0	0	106.5	S275 G279	S275-Q277 PolarHBondContact O-N 3.47Å; Q277-G279 PolarHBondContact O-N 3.31Å; Q277-G279 VanDerWaalsContact O-N 3.11Å
278	D	40.8	Very low	47.3	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	77%	0.768	S	S	*	*			trans	-60.6	109.9	165.4	-78.3	-35.5	0	0	0	108.1	T276	T276-D278 PolarHBondContact O-N 2.85Å
279	G	37.4	Very low	45.2	Very low	76 Å²	76	139 Å²	139	78%	0.784	76%	0.763	S	S	*	*			trans	-106.9	86	169.9	0	0	0	0	0	109.5	Q277	Q277-G279 PolarHBondContact O-N 3.31Å; Q277-G279 VanDerWaalsContact O-N 3.11Å
280	E	39.8	Very low	43.2	Very low	179 Å²	179	132.5 Å²	132.5	84%	0.836	76%	0.763	S	S	*	*			trans	-65.2	131	159.8	-86.4	-166	147.6	0	0	109.8
281	S	43.2	Very low	42.2	Very low	115 Å²	115	136.4 Å²	136.4	80%	0.804	78%	0.777	S	S	*	*			trans	-61.5	124.8	174.9	176.8	0	0	0	0	112.2
282	Y	35.8	Very low	41.2	Very low	211 Å²	211	136.8 Å²	136.8	83%	0.827	77%	0.772	S	S	*	*			trans	-151.1	140.5	142.8	41.6	-88	0	0	0	112.1
283	K	35.2	Very low	40.2	Very low	199 Å²	199	139.7 Å²	139.7	87%	0.865	78%	0.781	S	S	*	*			trans	-61.2	153.2	-167	-68.7	167.1	171.1	174.5	0	114.7
284	S	39.1	Very low	39.5	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	78%	0.782	S	S	*	*			trans	-52.5	155.8	163.1	-38	0	0	0	0	112.5
285	P	48	Very low	38.7	Very low	133 Å²	133	143.3 Å²	143.3	86%	0.864	78%	0.784	S	S	*	*				-151.3	163.1	85.2	37.1	-18.6	0	0	0	115.8
286	G	34.6	Very low	38.4	Very low	77 Å²	77	144.1 Å²	144.1	79%	0.794	78%	0.784	S	S	*	*			trans	137.2	93.3	151.4	0	0	0	0	0	117.7
287	K	38.8	Very low	38.5	Very low	189 Å²	189	143.1 Å²	143.1	82%	0.822	78%	0.782	S	S	*	*			trans	-20.3	147.8	147.9	-119.5	168.6	162.6	-170.2	0	114.7
288	H	33.7	Very low	38.6	Very low	130 Å²	130	142.6 Å²	142.6	60%	0.602	79%	0.785	S	S	*	*				-172.4	151.2	59.6	-140.8	-97.3	0	0	0	111.2
289	D	38.8	Very low	38.9	Very low	145 Å²	145	143.9 Å²	143.9	78%	0.775	79%	0.786	S	S	*	*			trans	56.9	133.4	155.4	-69.5	-12.8	0	0	0	124.4
290	G	36.9	Very low	39	Very low	78 Å²	78	142.8 Å²	142.8	80%	0.804	78%	0.775	S	S	*	*			trans	156.4	91.2	152.7	0	0	0	0	0	113.7
291	V	41.7	Very low	39.2	Very low	129 Å²	129	140.3 Å²	140.3	78%	0.782	77%	0.767	S	S	*	*			trans	-77	161.6	177.4	-159	0	0	0	0	111.4
292	N	37.2	Very low	39.1	Very low	108 Å²	108	144.6 Å²	144.6	58%	0.578	77%	0.772	S	S	*	*			trans	100.8	140.2	154	-66.5	-15.9	0	0	0	118.3
293	Y	35.8	Very low	39.4	Very low	193 Å²	193	144.7 Å²	144.7	76%	0.757	77%	0.771	S	S	*	*			cis	-167.4	165.1	-12.9	-86.3	-62.1	0	0	0	108.5
294	I	36	Very low	39.9	Very low	153 Å²	153	144.4 Å²	144.4	79%	0.785	77%	0.772	S	S	*	*			trans	76.7	105.7	153.7	-43.4	-150.7	0	0	0	117.3
295	R	36.9	Very low	40.1	Very low	212 Å²	212	149.1 Å²	149.1	80%	0.8	78%	0.778	S	S	*	*				61.6	117.3	81.6	-162.2	174.4	178.4	100.5	1.4	112.6
296	T	36.9	Very low	40.2	Very low	131 Å²	131	147.9 Å²	147.9	80%	0.804	77%	0.773	S	S	*	*				-156	128	79.4	39.2	0	0	0	0	112.8
297	S	43.3	Very low	40.9	Very low	91 Å²	91	148.3 Å²	148.3	64%	0.636	76%	0.763	S	S	*	*			trans	-80.6	148.9	154.1	30.6	0	0	0	0	110.1
298	D	41.7	Very low	41.2	Very low	175 Å²	175	148.6 Å²	148.6	94%	0.936	77%	0.765	S	S	*	*			trans	-142.9	124.5	137.3	-134.4	1.7	0	0	0	110.1
299	E	46.6	Very low	41.6	Very low	183 Å²	183	147.8 Å²	147.8	86%	0.855	77%	0.769	S	S	*	*			trans	-135.8	142.5	-173.3	176.1	104	-140.7	0	0	105.4
300	G	39.6	Very low	41.8	Very low	53 Å²	53	152.2 Å²	152.2	55%	0.546	79%	0.79	S	S	.	*			trans	157.5	99.6	167.1	0	0	0	0	0	109.9
301	D	42.8	Very low	42	Very low	126 Å²	126	155.9 Å²	155.9	67%	0.674	79%	0.789	S	S	*	*				47.9	100.9	63.6	-161.3	29.6	0	0	0	113.1
302	F	41.3	Very low	42.1	Very low	205 Å²	205	157.3 Å²	157.3	90%	0.899	79%	0.79	S	S	*	*			trans	-118.3	109.5	165.1	-82	-79.3	0	0	0	110
303	R	42.8	Very low	42.3	Very low	214 Å²	214	160.1 Å²	160.1	81%	0.808	80%	0.802	S	S	*	*			trans	-68.9	148.9	-179.9	-68.6	-174.3	169.5	-159.8	-2.1	114
304	H	44.5	Very low	42.7	Very low	192 Å²	192	158.1 Å²	158.1	89%	0.889	80%	0.804	S	S	*	*			trans	-54	141.4	156.3	-75.6	169	0	0	0	112.6
305	K	44.8	Very low	43.1	Very low	214 Å²	214	158.4 Å²	158.4	93%	0.93	81%	0.806	S	S	*	*			trans	-129	126.9	156.9	-86.9	-173.8	175.5	-178.8	0	110.1
306	S	48.9	Very low	43.6	Very low	108 Å²	108	154.9 Å²	154.9	76%	0.755	81%	0.806	S	S	*	*			trans	-123.7	128.3	160.9	-174.4	0	0	0	0	108.6
307	S	49.5	Very low	44	Very low	85 Å²	85	156.6 Å²	156.6	59%	0.594	81%	0.806	S	S	*	*			trans	70.3	138.3	137.6	70.6	0	0	0	0	125.1
308	F	44.9	Very low	44.1	Very low	195 Å²	195	161.6 Å²	161.6	86%	0.855	82%	0.819	S	S	*	*			trans	76.9	146.9	150	-67.5	-55.3	0	0	0	119.7
309	V	42.1	Very low	44.3	Very low	114 Å²	114	160.5 Å²	160.5	69%	0.691	81%	0.809	S	S	*	*			cis	-164.1	147.8	-5	149.8	0	0	0	0	106.9
310	I	43.5	Very low	44.1	Very low	237 Å²	237	158.5 Å²	158.5	100%	1.215	81%	0.805	S	S	*	*				-166.9	0	119	-86	161	0	0	0	106.9

Retrieved 310 of 310 residues in 190.5 ms (Link to these results)

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