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Probable non-functional immunoglobulin lambda variable 11-55

Probable non-functional open reading frame (ORF) of V region of the variable domain of immunoglobulin light chains¹. Non-functional ORF generally cannot participate in the synthesis of a productive immunoglobulin chain due to altered V-(D)-J or switch recombination and/or splicing site (at mRNA level) and/or conserved amino acid change (protein level)². Immunoglobulins, also known as antibodies, are membrane-bound or secreted glycoproteins produced by B lymphocytes. In the recognition phase of humoral immunity, the membrane-bound immunoglobulins serve as receptors which, upon binding of a specific antigen, trigger the clonal expansion and differentiation of B lymphocytes into immunoglobulins-secreting plasma cells. Secreted immunoglobulins mediate the effector phase of humoral immunity, which results in the elimination of bound antigens^3,4. The antigen binding site is formed by the variable domain of one heavy chain, together with that of its associated light chain. Thus, each immunoglobulin has two antigen binding sites with remarkable affinity for a particular antigen. The variable domains are assembled by a process called V-(D)-J rearrangement and can then be subjected to somatic hypermutations which, after exposure to antigen and selection, allow affinity maturation for a particular antigen^5,6.

AlphaFold DB , UniProt , Accession A0A075B6I3, Species HUMAN (Homo sapiens, Human), Gene IGLV11-55, Length 123 aa.

						>LVK55_HUMAN|A0A075B6I3|IGLV11-55
MALTPLLLLLLSHCTGSLSRPVLTQPPSLSASPGATARLPCTLSSDLSVGGKNMFWYQQKLGSSPRLFLYHYSDSDKQLGPGVPSRVSGSKETSSNTAFLLISGLQPEDEADYYCQVYESSAN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.9	Low	62.2	Low	237 Å²	237	123.1 Å²	123.1	100%	1.167	68%	0.676	S	S	*	*				0	80.7	0	-71.3	166.8	47.4	0	0	109.1
2	A	64.5	Low	62.2	Low	79 Å²	79	120.1 Å²	120.1	65%	0.653	67%	0.67	S	S	*	*			trans	-130.8	14.8	-174.9	0	0	0	0	0	113.2	P5	A2-P5 WeakPolarHBondContact O-CD 3.15Å
3	L	61.5	Low	61.9	Low	145 Å²	145	121 Å²	121	76%	0.759	67%	0.666	S	S	*	*			trans	-85.8	-14	174.8	-89.2	96	0	0	0	113.5	L6 L7	L3-L6 PolarHBondContact O-N 3.46Å; L3-L7 PolarHBondContact O-N 3.23Å
4	T	62.5	Low	61.8	Low	99 Å²	99	121.2 Å²	121.2	61%	0.607	68%	0.678	S	S	*	*	H	α-helix	trans	-59.5	-43.3	178.1	33.2	0	0	0	0	114.5	L8	T4-L8 PolarHBondContact O-N 3.28Å
5	P	63.9	Low	61.9	Low	71 Å²	71	122.1 Å²	122.1	46%	0.461	69%	0.688	S	S	.	*	H	α-helix	trans	-70	-33.6	178.2	25.9	-33.6	0	0	0	113	A2 L7 L8 L9	A2-P5 WeakPolarHBondContact O-CD 3.15Å; P5-L7 VanDerWaalsContact C-N 3.33Å; P5-L7 PolarHBondContact O-N 3.04Å; P5-L8 PolarHBondContact O-N 3.24Å; P5-L9 PolarHBondContact O-N 3.3Å; P5-L9 VanDerWaalsContact O-N 3.07Å
6	L	63.1	Low	61.9	Low	109 Å²	109	118.8 Å²	118.8	57%	0.571	69%	0.689	S	S	*	*	H	α-helix	trans	-67.4	-35.9	179.9	-168.5	67	0	0	0	111.6	L3 L9 L10	L3-L6 PolarHBondContact O-N 3.46Å; L6-L9 PolarHBondContact O-N 3.25Å; L6-L10 PolarHBondContact O-N 3.48Å; L6-L10 VanDerWaalsContact O-N 3.09Å
7	L	64.8	Low	62.2	Low	114 Å²	114	117.8 Å²	117.8	60%	0.597	69%	0.691	S	S	*	*	H	α-helix	trans	-66.8	-42.4	174.9	-160.5	75.1	0	0	0	111.5	L3 P5 L9 L10 L11	L3-L7 PolarHBondContact O-N 3.23Å; P5-L7 VanDerWaalsContact C-N 3.33Å; P5-L7 PolarHBondContact O-N 3.04Å; L7-L9 VanDerWaalsContact C-N 3.33Å; L7-L9 PolarHBondContact O-N 3.25Å; L7-L10 PolarHBondContact O-N 3.16Å; L7-L11 HydrophobicContact CG-CD1 4.16Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 PolarHBondContact O-N 2.82Å
8	L	65	Low	62.2	Low	133 Å²	133	120.9 Å²	120.9	70%	0.696	70%	0.703	S	S	*	*	H	α-helix	trans	-61.6	-38.8	176.2	-80.1	154.3	0	0	0	112.6	T4 P5	T4-L8 PolarHBondContact O-N 3.28Å; P5-L8 PolarHBondContact O-N 3.24Å
9	L	63.6	Low	62.4	Low	106 Å²	106	119.3 Å²	119.3	56%	0.555	70%	0.699	S	S	*	*	H	α-helix	trans	-65.4	-43.6	173.5	-83.2	150	0	0	0	111.5	P5 L6 L7 L11 S12 H13	P5-L9 PolarHBondContact O-N 3.3Å; P5-L9 VanDerWaalsContact O-N 3.07Å; L6-L9 PolarHBondContact O-N 3.25Å; L7-L9 VanDerWaalsContact C-N 3.33Å; L7-L9 PolarHBondContact O-N 3.25Å; L9-L11 VanDerWaalsContact C-N 3.32Å; L9-L11 PolarHBondContact O-N 2.94Å; L9-S12 WeakPolarHBondContact O-CB 3.37Å; L9-S12 PolarHBondContact O-N 2.91Å; L9-S12 VanDerWaalsContact O-N 3.09Å; L9-H13 PolarHBondContact O-CE1 2.96Å; L9-H13 PolarHBondContact O-ND1 2.89Å
10	L	60.6	Low	62.7	Low	123 Å²	123	124.2 Å²	124.2	64%	0.644	71%	0.705	S	S	*	*	H	α-helix	trans	-61.3	-37.4	-178.6	-118.4	83.2	0	0	0	113.2	L6 L7 S12	L6-L10 PolarHBondContact O-N 3.48Å; L6-L10 VanDerWaalsContact O-N 3.09Å; L7-L10 PolarHBondContact O-N 3.16Å; L10-S12 PolarHBondContact O-N 2.91Å
11	L	60.7	Low	63.1	Low	138 Å²	138	121.2 Å²	121.2	72%	0.723	69%	0.691	S	S	*	*	H	α-helix	trans	-69.3	-16.7	177.4	-84.4	108	0	0	0	113.9	L7 L9 H13	L7-L11 HydrophobicContact CG-CD1 4.16Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 PolarHBondContact O-N 2.82Å; L9-L11 VanDerWaalsContact C-N 3.32Å; L9-L11 PolarHBondContact O-N 2.94Å; L11-H13 VanDerWaalsContact C-N 3.27Å; L11-H13 PolarHBondContact O-N 3.49Å
12	S	62.8	Low	64.7	Low	87 Å²	87	113.9 Å²	113.9	61%	0.608	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-6.2	-177.7	-170.5	0	0	0	0	114.5	L9 L10	L9-S12 WeakPolarHBondContact O-CB 3.37Å; L9-S12 PolarHBondContact O-N 2.91Å; L9-S12 VanDerWaalsContact O-N 3.09Å; L10-S12 PolarHBondContact O-N 2.91Å
13	H	58	Low	66.1	Low	132 Å²	132	112.7 Å²	112.7	61%	0.611	64%	0.641	S	S	*	*	S	Bend	trans	-114.2	50	-168.5	-51.4	95.6	0	0	0	113.2	L9 L11	L9-H13 PolarHBondContact O-CE1 2.96Å; L9-H13 PolarHBondContact O-ND1 2.89Å; L11-H13 VanDerWaalsContact C-N 3.27Å; L11-H13 PolarHBondContact O-N 3.49Å
14	C	60.5	Low	67.8	Low	124 Å²	124	109.7 Å²	109.7	84%	0.838	63%	0.629	S	S	*	*			trans	-164.7	31.3	165.6	-105.2	0	0	0	0	115.3	G16	C14-G16 PolarHBondContact O-N 3.33Å; C14-G16 VanDerWaalsContact O-N 3.13Å
15	T	62.9	Low	69.5	Low	135 Å²	135	107.9 Å²	107.9	83%	0.828	61%	0.613	S	S	*	*			trans	-87.9	47.9	169.3	-31.9	0	0	0	0	111.3	S17	T15-S17 VanDerWaalsContact C-N 3.26Å; T15-S17 PolarHBondContact O-N 2.77Å; T15-S17 VanDerWaalsContact O-N 3.14Å
16	G	61.9	Low	71.1	Confident	68 Å²	68	107.4 Å²	107.4	70%	0.701	61%	0.61	S	S	*	*			trans	-79.6	80.5	161.4	0	0	0	0	0	108.1	C14 L18	C14-G16 PolarHBondContact O-N 3.33Å; C14-G16 VanDerWaalsContact O-N 3.13Å; G16-L18 PolarHBondContact O-N 2.97Å; G16-L18 VanDerWaalsContact O-N 3.1Å
17	S	67.4	Low	72.7	Confident	103 Å²	103	108.8 Å²	108.8	72%	0.72	63%	0.626	S	S	*	*			trans	-74.1	102.2	168.3	-164.8	0	0	0	0	107	T15 S19	T15-S17 VanDerWaalsContact C-N 3.26Å; T15-S17 PolarHBondContact O-N 2.77Å; T15-S17 VanDerWaalsContact O-N 3.14Å; S17-S19 PolarHBondContact O-N 3.14Å
18	L	61.7	Low	74.2	Confident	174 Å²	174	107.8 Å²	107.8	91%	0.911	63%	0.628	S	S	*	*			trans	-66.4	83.1	164.1	-68.8	163	0	0	0	106.7	G16 R20	G16-L18 PolarHBondContact O-N 2.97Å; G16-L18 VanDerWaalsContact O-N 3.1Å; L18-R20 PolarHBondContact O-N 2.76Å; L18-R20 VanDerWaalsContact O-N 3.17Å
19	S	66.3	Low	75.8	Confident	90 Å²	90	105.1 Å²	105.1	63%	0.629	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-66.4	116.5	171.2	56.9	0	0	0	0	107.4	S17	S17-S19 PolarHBondContact O-N 3.14Å
20	R	68.5	Low	77.4	Confident	217 Å²	217	105.7 Å²	105.7	82%	0.819	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-58.5	139.9	174.2	-168.9	173.1	-175.9	175.2	0.3	108.7	L18 V22	L18-R20 PolarHBondContact O-N 2.76Å; L18-R20 VanDerWaalsContact O-N 3.17Å; R20-V22 VanDerWaalsContact O-CG2 3.28Å; R20-V22 WeakPolarHBondContact O-CG2 3.45Å; R20-V22 PolarHBondContact O-N 3.11Å
21	P	70.8	Confident	79.1	Confident	62 Å²	62	102.3 Å²	102.3	40%	0.403	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-52.6	130.6	175.2	-24.2	31.5	0	0	0	110.2	L47	P21-L47 HydrophobicContact CB-CD1 3.42Å; P21-L47 VanDerWaalsContact CB-CD1 3.42Å; P21-L47 HydrophobicContact CB-CG 4.13Å; P21-L47 HydrophobicContact CG-CD1 3.87Å; P21-L47 HydrophobicContact CG-CG 4.39Å
22	V	87.5	Confident	80.8	Confident	82 Å²	82	99.9 Å²	99.9	50%	0.497	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-102.9	122.7	-171.9	-175.9	0	0	0	0	108.6	R20 S44	R20-V22 VanDerWaalsContact O-CG2 3.28Å; R20-V22 WeakPolarHBondContact O-CG2 3.45Å; R20-V22 PolarHBondContact O-N 3.11Å; V22-S44 PolarHBondContact N-OG 3.02Å; V22-S44 PolarHBondContact O-N 2.93Å
23	L	95	Very high	82.5	Confident	55 Å²	55	100.9 Å²	100.9	29%	0.288	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.1	129.4	166.1	-61.1	179.5	0	0	0	108.4	T42 L43 C115 V117	L23-T42 WeakPolarHBondContact CA-O 3.39Å; L23-L43 HydrophobicContact CD2-CB 4.41Å; L23-L43 HydrophobicContact CD2-CD1 3.88Å; L23-L43 HydrophobicContact CD2-CG 3.65Å; L23-C115 WeakPolarHBondContact CD1-O 3.47Å; L23-V117 HydrophobicContact CD1-CG1 4.21Å; L23-V117 HydrophobicContact CD2-CB 4.24Å; L23-V117 HydrophobicContact CD2-CG1 3.88Å; L23-V117 HydrophobicContact CG-CG1 4.37Å
24	T	96.6	Very high	84.4	Confident	82 Å²	82	96.9 Å²	96.9	50%	0.503	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.1	127.3	178.3	-54.9	0	0	0	0	109.9	C41 T42	T24-C41 WeakPolarHBondContact O-CA 3.46Å; T24-T42 PolarHBondContact N-O 2.81Å; T24-T42 PolarHBondContact O-N 2.96Å
25	Q	98.1	Very high	86.2	Confident	60 Å²	60	92.9 Å²	92.9	28%	0.28	59%	0.587	S	S	.	*			trans	-126.4	149.6	174	-66.3	-178.1	-114.2	0	0	109.1	C41 Y113 C115	Q25-C41 HydrophobicContact CG-CB 4.26Å; Q25-Y113 PolarHBondContact NE2-O 2.8Å; Q25-C115 VanDerWaalsContact CD-SG 3.56Å; Q25-C115 PolarHBondContact OE1-SG 2.89Å
26	P	97.6	Very high	87.9	Confident	61 Å²	61	90.5 Å²	90.5	40%	0.396	57%	0.572	S	S	.	*			trans	-63.1	146.9	169	27.4	-33.8	0	0	0	109.6	S28 P40	P26-S28 PolarHBondContact O-N 2.96Å; P26-P40 HydrophobicContact CG-CG 3.98Å
27	P	96.4	Very high	89.6	Confident	138 Å²	138	87.5 Å²	87.5	90%	0.896	54%	0.541	S	S	*	.	S	Bend	trans	-68.2	-23.9	-176.7	28.1	-35.6	0	0	0	113.1
28	S	97.4	Very high	91.1	Very high	93 Å²	93	88.3 Å²	88.3	65%	0.65	53%	0.528	S	S	*	.			trans	-156.7	157.5	176.2	59.3	0	0	0	0	110.2	P26	P26-S28 PolarHBondContact O-N 2.96Å
29	L	97.2	Very high	92.9	Very high	77 Å²	77	81 Å²	81	40%	0.403	49%	0.49	S	S	.	.			trans	-141.9	137.3	172.3	-176.3	145.1	0	0	0	108.2	A31 A37 R38 L39	L29-A31 HydrophobicContact CD2-CB 4.46Å; L29-A37 HydrophobicContact CD2-CB 4.01Å; L29-R38 WeakPolarHBondContact CD1-O 3.45Å; L29-L39 HydrophobicContact CD1-CG 4.29Å
30	S	97.3	Very high	94.4	Very high	119 Å²	119	78.4 Å²	78.4	83%	0.832	47%	0.47	S	S	*	.			trans	-129.3	140.5	176.6	-55.9	0	0	0	0	109.8
31	A	96.4	Very high	95.8	Very high	52 Å²	52	68 Å²	68	43%	0.43	43%	0.431	S	S	.	.			trans	-151.6	154.6	178.6	0	0	0	0	0	109.7	L29 L105	L29-A31 HydrophobicContact CD2-CB 4.46Å; A31-L105 HydrophobicContact CB-CD1 3.4Å
32	S	97.5	Very high	97.1	Very high	86 Å²	86	67.5 Å²	67.5	60%	0.601	43%	0.427	S	S	*	.			trans	-73.8	149.6	-178.2	-55	0	0	0	0	112	G34 A35	S32-G34 PolarHBondContact O-N 2.92Å; S32-A35 WeakPolarHBondContact O-CB 3.1Å; S32-A35 PolarHBondContact O-N 2.78Å
33	P	97.9	Very high	97.4	Very high	108 Å²	108	63.9 Å²	63.9	70%	0.701	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	139.1	170.8	-26.7	35	0	0	0	112	A35	P33-A35 PolarHBondContact O-N 2.98Å
34	G	98.1	Very high	97.3	Very high	49 Å²	49	62.7 Å²	62.7	51%	0.505	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	-14.7	-176	0	0	0	0	0	115.3	S32 L105	S32-G34 PolarHBondContact O-N 2.92Å; G34-L105 PolarHBondContact N-O 3.13Å
35	A	98.3	Very high	96.8	Very high	39 Å²	39	64.8 Å²	64.8	32%	0.322	42%	0.419	S	S	.	.	S	Bend	trans	-72.5	174.4	174.3	0	0	0	0	0	111.7	S32 P33 G104 L105	S32-A35 WeakPolarHBondContact O-CB 3.1Å; S32-A35 PolarHBondContact O-N 2.78Å; P33-A35 PolarHBondContact O-N 2.98Å; A35-G104 PolarHBondContact O-N 3Å; A35-G104 VanDerWaalsContact O-N 3.16Å; A35-L105 HydrophobicContact CB-CD1 4.41Å; A35-L105 WeakPolarHBondContact O-CG 3.14Å; A35-L105 PolarHBondContact O-N 3.4Å
36	T	98.3	Very high	96.2	Very high	85 Å²	85	66.6 Å²	66.6	52%	0.521	43%	0.43	S	S	.	.			trans	-101	114.9	171.4	-60.8	0	0	0	0	109.6	I102	T36-I102 CarbonylContact C-O 3.5Å; T36-I102 VanDerWaalsContact CA-O 3.3Å; T36-I102 WeakPolarHBondContact CA-O 3.33Å
37	A	98.2	Very high	95.6	Very high	5 Å²	5	65 Å²	65	4%	0.041	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	138.8	168.1	0	0	0	0	0	110.1	L29 L39 L101 I102 L105	L29-A37 HydrophobicContact CD2-CB 4.01Å; A37-L39 HydrophobicContact CB-CD1 3.75Å; A37-L101 WeakPolarHBondContact O-CA 3.33Å; A37-I102 HydrophobicContact CB-CB 4.44Å; A37-I102 PolarHBondContact N-O 2.89Å; A37-I102 PolarHBondContact O-N 2.96Å; A37-L105 HydrophobicContact CB-CD1 3.81Å; A37-L105 HydrophobicContact CB-CD2 3.82Å; A37-L105 HydrophobicContact CB-CG 4.1Å
38	R	98.2	Very high	95.4	Very high	121 Å²	121	61.7 Å²	61.7	46%	0.457	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	98.9	174.7	178	169.8	-174.9	-118.1	9.3	109.1	L29 P40 F99 L100 L101	L29-R38 WeakPolarHBondContact CD1-O 3.45Å; R38-P40 WeakPolarHBondContact O-CD 3.5Å; R38-F99 HydrophobicContact CG-CB 4.27Å; R38-F99 HydrophobicContact CG-CD1 3.49Å; R38-F99 VanDerWaalsContact CG-CD1 3.49Å; R38-F99 HydrophobicContact CG-CE1 4.14Å; R38-F99 HydrophobicContact CG-CG 4.13Å; R38-F99 VanDerWaalsContact NE-CD1 3.33Å; R38-L100 WeakPolarHBondContact CA-O 3.39Å; R38-L101 HydrophobicContact CB-CD2 3.83Å; R38-L101 HydrophobicContact CG-CD2 3.63Å
39	L	98.4	Very high	95.2	Very high	21 Å²	21	57.3 Å²	57.3	11%	0.11	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117	-177.3	-64.6	77.9	0	0	0	109.2	L29 A37 W56 F99 L100 Y113	L29-L39 HydrophobicContact CD1-CG 4.29Å; A37-L39 HydrophobicContact CB-CD1 3.75Å; L39-W56 HydrophobicContact CB-CH2 4.36Å; L39-W56 HydrophobicContact CB-CZ3 4.35Å; L39-W56 WeakPolarHBondContact O-CH2 3.35Å; L39-F99 VanDerWaalsContact O-CA 3.29Å; L39-F99 WeakPolarHBondContact O-CA 3.22Å; L39-L100 HydrophobicContact CB-CB 4.28Å; L39-L100 PolarHBondContact N-O 3.09Å; L39-L100 PolarHBondContact O-N 2.94Å; L39-Y113 HydrophobicContact CD2-CD2 3.81Å; L39-Y113 HydrophobicContact CD2-CG 3.83Å
40	P	98.4	Very high	95	Very high	34 Å²	34	55.2 Å²	55.2	22%	0.221	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	147.1	177.6	29.8	-29.4	0	0	0	112.4	P26 R38 T97 A98 F99	P26-P40 HydrophobicContact CG-CG 3.98Å; R38-P40 WeakPolarHBondContact O-CD 3.5Å; P40-T97 HydrophobicContact CB-CG2 3.7Å; P40-A98 CarbonylContact C-O 3.56Å; P40-F99 HydrophobicContact CB-CD1 3.92Å; P40-F99 HydrophobicContact CB-CE1 3.64Å
41	C	98.1	Very high	94.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	104.4	165.4	173.5	0	0	0	0	108.5	T24 Q25 W56 T97 A98 C115	T24-C41 WeakPolarHBondContact O-CA 3.46Å; Q25-C41 HydrophobicContact CG-CB 4.26Å; C41-W56 HydrophobicContact CB-CH2 3.49Å; C41-W56 VanDerWaalsContact CB-CH2 3.49Å; C41-W56 HydrophobicContact CB-CZ2 3.69Å; C41-W56 HydrophobicContact CB-CZ3 4.38Å; C41-T97 WeakPolarHBondContact O-CA 3.4Å; C41-A98 PolarHBondContact N-O 3.34Å; C41-A98 PolarHBondContact O-N 3.32Å; C41-C115 HydrophobicContact CB-CB 3.45Å; C41-C115 VanDerWaalsContact CB-CB 3.45Å; C41-C115 WeakPolarHBondContact CB-SG 3.25Å; C41-C115 WeakPolarHBondContact SG-CB 3.46Å; C41-C115 CovalentContact SG-SG 2.02Å; C41-C115 PolarHBondContact SG-SG 2.88Å
42	T	97.4	Very high	94.4	Very high	51 Å²	51	49.8 Å²	49.8	31%	0.313	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.8	-177	-56.4	0	0	0	0	109.9	L23 T24 T97	L23-T42 WeakPolarHBondContact CA-O 3.39Å; T24-T42 PolarHBondContact N-O 2.81Å; T24-T42 PolarHBondContact O-N 2.96Å; T42-T97 PolarHBondContact OG1-OG1 2.83Å
43	L	94.9	Very high	94.3	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.031	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	145.3	176.3	-74.9	64.4	0	0	0	109.5	L23 L47 V49 M54 N96 V117	L23-L43 HydrophobicContact CD2-CB 4.41Å; L23-L43 HydrophobicContact CD2-CD1 3.88Å; L23-L43 HydrophobicContact CD2-CG 3.65Å; L43-L47 HydrophobicContact CD2-CB 4.28Å; L43-V49 HydrophobicContact CD1-CB 4.33Å; L43-V49 HydrophobicContact CD1-CG2 4.07Å; L43-V49 HydrophobicContact CD2-CB 4Å; L43-V49 HydrophobicContact CD2-CG2 4.27Å; L43-M54 HydrophobicContact CD1-CE 4.11Å; L43-M54 HydrophobicContact CD1-SD 4.25Å; L43-N96 WeakPolarHBondContact CB-ND2 3.28Å; L43-N96 PolarHBondContact N-O 2.88Å; L43-N96 PolarHBondContact O-ND2 2.91Å; L43-V117 HydrophobicContact CD2-CB 4.38Å; L43-V117 HydrophobicContact CD2-CG2 3.83Å
44	S	91.8	Very high	94.3	Very high	29 Å²	29	41.4 Å²	41.4	20%	0.203	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-58.4	152.2	169.5	51.8	0	0	0	0	111.8	V22 D46 L47 N96	V22-S44 PolarHBondContact N-OG 3.02Å; V22-S44 PolarHBondContact O-N 2.93Å; S44-D46 WeakPolarHBondContact CB-OD1 3.3Å; S44-D46 PolarHBondContact O-N 2.86Å; S44-D46 VanDerWaalsContact O-N 3.12Å; S44-D46 PolarHBondContact OG-OD1 3.47Å; S44-L47 PolarHBondContact O-N 3.04Å; S44-L47 VanDerWaalsContact O-N 3.07Å; S44-N96 PolarHBondContact O-ND2 3.37Å; S44-N96 VanDerWaalsContact O-ND2 3.08Å
45	S	87.5	Confident	94.3	Very high	126 Å²	126	41.2 Å²	41.2	88%	0.881	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.5	-169	54.3	0	0	0	0	115.1	L47	S45-L47 PolarHBondContact O-N 3.23Å
46	D	85.1	Confident	94.3	Very high	98 Å²	98	39.4 Å²	39.4	52%	0.524	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.8	174.8	61.8	-47.5	0	0	0	113	S44	S44-D46 WeakPolarHBondContact CB-OD1 3.3Å; S44-D46 PolarHBondContact O-N 2.86Å; S44-D46 VanDerWaalsContact O-N 3.12Å; S44-D46 PolarHBondContact OG-OD1 3.47Å
47	L	85.5	Confident	94.3	Very high	27 Å²	27	38.2 Å²	38.2	14%	0.141	23%	0.226	C	C	.	.	S	Bend	trans	-115.3	147.9	176.8	-61.4	-176.3	0	0	0	111.2	P21 L43 S44 S45 N96 V117	P21-L47 HydrophobicContact CB-CD1 3.42Å; P21-L47 VanDerWaalsContact CB-CD1 3.42Å; P21-L47 HydrophobicContact CB-CG 4.13Å; P21-L47 HydrophobicContact CG-CD1 3.87Å; P21-L47 HydrophobicContact CG-CG 4.39Å; L43-L47 HydrophobicContact CD2-CB 4.28Å; S44-L47 PolarHBondContact O-N 3.04Å; S44-L47 VanDerWaalsContact O-N 3.07Å; S45-L47 PolarHBondContact O-N 3.23Å; L47-N96 PolarHBondContact O-ND2 2.54Å; L47-N96 PolarHBondContact O-OD1 2.85Å; L47-V117 HydrophobicContact CD1-CG1 4.33Å
48	S	91.3	Very high	94.3	Very high	70 Å²	70	38.2 Å²	38.2	49%	0.49	23%	0.225	S	C	.	.			trans	-107.5	124.2	170.5	173.6	0	0	0	0	111	G50 K52 N96	S48-G50 PolarHBondContact O-N 2.82Å; S48-K52 WeakPolarHBondContact O-CG 3.5Å; S48-N96 WeakPolarHBondContact CA-OD1 3.18Å
49	V	94.3	Very high	94.3	Very high	0 Å²	0	35 Å²	35	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-63.1	-24.5	179.9	70.8	0	0	0	0	113.9	L43 G51 K52 M54 K91 T93 N96 A98	L43-V49 HydrophobicContact CD1-CB 4.33Å; L43-V49 HydrophobicContact CD1-CG2 4.07Å; L43-V49 HydrophobicContact CD2-CB 4Å; L43-V49 HydrophobicContact CD2-CG2 4.27Å; V49-G51 PolarHBondContact O-N 3.16Å; V49-K52 PolarHBondContact O-N 2.71Å; V49-M54 HydrophobicContact CG2-CG 4.38Å; V49-M54 HydrophobicContact CG2-SD 4.15Å; V49-K91 HydrophobicContact CG1-CB 4.49Å; V49-K91 HydrophobicContact CG2-CB 4.42Å; V49-K91 HydrophobicContact CG2-CD 4.1Å; V49-K91 HydrophobicContact CG2-CG 4Å; V49-K91 WeakPolarHBondContact O-CD 2.98Å; V49-K91 WeakPolarHBondContact O-CE 3.39Å; V49-K91 PolarHBondContact O-NZ 3.29Å; V49-T93 HydrophobicContact CG1-CG2 4.16Å; V49-N96 PolarHBondContact N-OD1 3.1Å; V49-A98 HydrophobicContact CG2-CB 3.91Å
50	G	92.3	Very high	94.3	Very high	34 Å²	34	37.9 Å²	37.9	35%	0.351	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-58	-45.9	-172.7	0	0	0	0	0	113.3	S48 K91	S48-G50 PolarHBondContact O-N 2.82Å; G50-K91 PolarHBondContact O-NZ 2.85Å
51	G	89.5	Confident	94.1	Very high	34 Å²	34	44.8 Å²	44.8	35%	0.351	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-102.3	27.9	-177.9	0	0	0	0	0	114.4	V49	V49-G51 PolarHBondContact O-N 3.16Å
52	K	92.1	Very high	94	Very high	22 Å²	22	48.9 Å²	48.9	10%	0.096	30%	0.303	C	S	.	.	S	Bend	trans	-120.2	146.2	-174.2	-62.5	-72.9	-178	-96.8	0	112.4	S48 V49 M54 K91 V117 E119	S48-K52 WeakPolarHBondContact O-CG 3.5Å; V49-K52 PolarHBondContact O-N 2.71Å; K52-M54 PolarHBondContact O-N 2.79Å; K52-K91 PolarHBondContact O-NZ 3.46Å; K52-V117 HydrophobicContact CB-CG2 3.54Å; K52-V117 HydrophobicContact CD-CG2 4.2Å; K52-V117 HydrophobicContact CG-CG2 3.97Å; K52-E119 HydrophobicContact CD-CB 3.81Å; K52-E119 HydrophobicContact CD-CG 4.17Å; K52-E119 VanDerWaalsContact CE-CD 3.49Å; K52-E119 WeakPolarHBondContact CE-OE1 3.15Å; K52-E119 IonicContact NZ-OE1 2.77Å; K52-E119 PolarHBondContact NZ-OE1 3.46Å; K52-E119 IonicContact NZ-OE2 3.66Å
53	N	95.3	Very high	93.9	Very high	18 Å²	18	49.5 Å²	49.5	10%	0.096	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.6	175.4	-63.3	-72.7	0	0	0	108.8	F55 Y70 Y72 V117 Y118	N53-F55 HydrophobicContact CB-CD2 4.5Å; N53-F55 HydrophobicContact CB-CE2 3.71Å; N53-F55 HydrophobicContact CB-CZ 4.31Å; N53-Y70 HydrophobicContact CB-CE2 3.94Å; N53-Y70 WeakPolarHBondContact OD1-CE2 3.4Å; N53-Y70 PolarHBondContact OD1-OH 3.26Å; N53-Y70 VanDerWaalsContact OD1-OH 3.09Å; N53-Y72 VanDerWaalsContact OD1-CD2 3.31Å; N53-Y72 WeakPolarHBondContact OD1-CD2 3.42Å; N53-V117 CarbonylContact O-C 3.25Å; N53-V117 WeakPolarHBondContact O-CA 3.42Å; N53-Y118 WeakPolarHBondContact CB-O 3.14Å; N53-Y118 PolarHBondContact N-O 2.79Å; N53-Y118 PolarHBondContact ND2-O 3.05Å; N53-Y118 PolarHBondContact O-N 3.18Å
54	M	96.9	Very high	94	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.8	176.5	-60.1	-54.7	-51.1	0	0	109.7	L43 V49 K52 Y70 H71 A98 V117	L43-M54 HydrophobicContact CD1-CE 4.11Å; L43-M54 HydrophobicContact CD1-SD 4.25Å; V49-M54 HydrophobicContact CG2-CG 4.38Å; V49-M54 HydrophobicContact CG2-SD 4.15Å; K52-M54 PolarHBondContact O-N 2.79Å; M54-Y70 CarbonylContact O-C 3.58Å; M54-Y70 WeakPolarHBondContact O-CA 3.49Å; M54-H71 WeakPolarHBondContact CB-O 3.5Å; M54-H71 PolarHBondContact N-O 2.98Å; M54-H71 PolarHBondContact O-N 2.77Å; M54-A98 HydrophobicContact CB-CB 4.45Å; M54-A98 HydrophobicContact CE-CB 3.81Å; M54-A98 HydrophobicContact CG-CB 3.74Å; M54-A98 HydrophobicContact SD-CB 4.11Å; M54-V117 HydrophobicContact CE-CB 4.19Å; M54-V117 HydrophobicContact SD-CB 4Å; M54-V117 HydrophobicContact SD-CG2 3.81Å
55	F	98.2	Very high	94.3	Very high	44 Å²	44	56.1 Å²	56.1	19%	0.193	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.7	171.7	-59.3	-97.7	0	0	0	108.6	N53 Y57 L67 L69 Y70 C115 Q116	N53-F55 HydrophobicContact CB-CD2 4.5Å; N53-F55 HydrophobicContact CB-CE2 3.71Å; N53-F55 HydrophobicContact CB-CZ 4.31Å; F55-Y57 HydrophobicContact CB-CE2 3.69Å; F55-L67 HydrophobicContact CB-CD1 4.48Å; F55-L67 HydrophobicContact CD1-CD1 3.94Å; F55-L69 CarbonylContact C-O 3.56Å; F55-L69 WeakPolarHBondContact CA-O 3.31Å; F55-Y70 AromaticContact CD1-CD2 3.96Å; F55-Y70 HydrophobicContact CD1-CD2 3.96Å; F55-Y70 AromaticContact CE1-CD2 3.44Å; F55-Y70 HydrophobicContact CE1-CD2 3.44Å; F55-Y70 VanDerWaalsContact CE1-CD2 3.44Å; F55-Y70 HydrophobicContact CE1-CE2 4.25Å; F55-Y70 HydrophobicContact CE1-CG 4.16Å; F55-Y70 HydrophobicContact CE2-CD2 4.18Å; F55-Y70 HydrophobicContact CE2-CE2 4.49Å; F55-Y70 AromaticContact CZ-CD2 3.57Å; F55-Y70 HydrophobicContact CZ-CD2 3.57Å; F55-Y70 AromaticContact CZ-CE2 3.94Å; F55-Y70 HydrophobicContact CZ-CE2 3.94Å; F55-C115 CarbonylContact O-C 3.59Å; F55-C115 WeakPolarHBondContact O-CA 3.28Å; F55-Q116 HydrophobicContact CB-CB 4.26Å; F55-Q116 PolarHBondContact N-O 2.82Å; F55-Q116 PolarHBondContact O-N 3.18Å
56	W	98.7	Very high	94.8	Very high	1 Å²	1	55.3 Å²	55.3	0%	0.004	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.8	172.3	-69.5	91.9	0	0	0	108.4	L39 C41 F68 L69 L100 Y114 C115	L39-W56 HydrophobicContact CB-CH2 4.36Å; L39-W56 HydrophobicContact CB-CZ3 4.35Å; L39-W56 WeakPolarHBondContact O-CH2 3.35Å; C41-W56 HydrophobicContact CB-CH2 3.49Å; C41-W56 VanDerWaalsContact CB-CH2 3.49Å; C41-W56 HydrophobicContact CB-CZ2 3.69Å; C41-W56 HydrophobicContact CB-CZ3 4.38Å; W56-F68 HydrophobicContact CB-CB 4.5Å; W56-F68 WeakPolarHBondContact O-CA 3.34Å; W56-F68 VanDerWaalsContact O-CB 3.32Å; W56-F68 WeakPolarHBondContact O-CB 3.45Å; W56-F68 PolarHBondContact O-N 2.88Å; W56-L69 HydrophobicContact CB-CB 4.18Å; W56-L69 PolarHBondContact N-O 2.94Å; W56-L69 PolarHBondContact O-N 2.81Å; W56-L100 HydrophobicContact CB-CD1 4.25Å; W56-L100 HydrophobicContact CB-CD2 4.37Å; W56-L100 HydrophobicContact CD2-CB 3.59Å; W56-L100 HydrophobicContact CD2-CD1 4.43Å; W56-L100 HydrophobicContact CD2-CD2 4.14Å; W56-L100 HydrophobicContact CD2-CG 4.28Å; W56-L100 HydrophobicContact CE3-CB 3.83Å; W56-L100 HydrophobicContact CE3-CD2 3.93Å; W56-L100 HydrophobicContact CE3-CG 4.46Å; W56-L100 HydrophobicContact CG-CB 4.09Å; W56-L100 HydrophobicContact CG-CD1 4.05Å; W56-L100 HydrophobicContact CG-CD2 4.33Å; W56-L100 HydrophobicContact CG-CG 4.4Å; W56-L100 HydrophobicContact CH2-CB 3.98Å; W56-L100 HydrophobicContact CZ2-CB 3.79Å; W56-L100 VanDerWaalsContact CZ2-N 3.34Å; W56-L100 HydrophobicContact CZ3-CB 4.01Å; W56-Y114 CarbonylContact C-O 3.55Å; W56-Y114 WeakPolarHBondContact CA-O 3.31Å; W56-C115 HydrophobicContact CD2-CB 4.13Å; W56-C115 HydrophobicContact CE3-CB 3.91Å; W56-C115 HydrophobicContact CH2-CB 4Å; W56-C115 HydrophobicContact CZ2-CB 4.17Å; W56-C115 HydrophobicContact CZ3-CB 3.85Å
57	Y	98.6	Very high	95.5	Very high	61 Å²	61	53.4 Å²	53.4	24%	0.239	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.4	177.5	-61.3	-91.8	0	0	0	109.2	F55 R66 L67 Y113 Y114 Q116	F55-Y57 HydrophobicContact CB-CE2 3.69Å; Y57-R66 CarbonylContact C-O 3.57Å; Y57-R66 WeakPolarHBondContact CA-O 3.29Å; Y57-L67 HydrophobicContact CE1-CB 4.45Å; Y57-L67 HydrophobicContact CE1-CD1 4.37Å; Y57-Y113 VanDerWaalsContact O-CA 3.31Å; Y57-Y113 WeakPolarHBondContact O-CA 3.36Å; Y57-Y114 PolarHBondContact N-O 2.63Å; Y57-Y114 PolarHBondContact O-N 3.09Å; Y57-Q116 HydrophobicContact CE2-CB 3.9Å; Y57-Q116 PolarHBondContact OH-OE1 3.35Å
58	Q	98.5	Very high	96.1	Very high	5 Å²	5	52.1 Å²	52.1	2%	0.023	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.5	173.1	-177.5	-173.5	45.7	0	0	108.3	P65 R66 F68 A111 D112 Y113	Q58-P65 WeakPolarHBondContact O-CA 3.48Å; Q58-R66 PolarHBondContact N-O 3.34Å; Q58-R66 PolarHBondContact O-N 3.07Å; Q58-F68 HydrophobicContact CB-CB 3.98Å; Q58-F68 HydrophobicContact CB-CD2 3.63Å; Q58-F68 HydrophobicContact CB-CE2 4.3Å; Q58-F68 HydrophobicContact CB-CG 3.92Å; Q58-F68 HydrophobicContact CG-CD2 4.27Å; Q58-F68 HydrophobicContact CG-CE2 4.47Å; Q58-A111 HydrophobicContact CG-CB 3.58Å; Q58-D112 CarbonylContact C-O 3.55Å; Q58-D112 WeakPolarHBondContact CA-O 3.13Å; Q58-Y113 HydrophobicContact CB-CD1 4.16Å; Q58-Y113 HydrophobicContact CB-CE1 3.83Å; Q58-Y113 HydrophobicContact CG-CD1 4.37Å; Q58-Y113 HydrophobicContact CG-CE1 3.76Å; Q58-Y113 PolarHBondContact NE2-OH 2.95Å
59	Q	98.4	Very high	96.5	Very high	52 Å²	52	48.9 Å²	48.9	24%	0.243	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	114.3	173.7	-171.8	176.8	15.6	0	0	109.7	S63 P65 A111 D112 Y114	Q59-S63 VanDerWaalsContact CG-O 3.25Å; Q59-S63 WeakPolarHBondContact CG-O 3.39Å; Q59-S63 PolarHBondContact NE2-O 3.23Å; Q59-P65 HydrophobicContact CB-CB 4.34Å; Q59-P65 HydrophobicContact CB-CG 4.22Å; Q59-P65 HydrophobicContact CG-CG 4.13Å; Q59-A111 WeakPolarHBondContact O-CB 3.39Å; Q59-D112 HydrophobicContact CB-CB 4.35Å; Q59-D112 PolarHBondContact N-O 2.67Å; Q59-D112 PolarHBondContact O-N 3.02Å; Q59-Y114 HydrophobicContact CB-CD2 4.5Å; Q59-Y114 HydrophobicContact CB-CE2 3.9Å
60	K	97	Very high	96.6	Very high	83 Å²	83	50.6 Å²	50.6	36%	0.361	30%	0.299	S	S	.	.			trans	-84.1	154.5	170.6	-66.6	-170.9	173.4	-164.3	0	109.9	G62 S63 E108 A111	K60-G62 PolarHBondContact O-N 2.84Å; K60-S63 WeakPolarHBondContact O-CB 3.44Å; K60-S63 PolarHBondContact O-N 3.12Å; K60-E108 WeakPolarHBondContact CE-O 3.39Å; K60-E108 PolarHBondContact NZ-O 3.4Å; K60-A111 HydrophobicContact CG-CB 4.12Å
61	L	94.8	Very high	96.9	Very high	178 Å²	178	49.3 Å²	49.3	93%	0.932	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	127.8	178.5	-173.6	65.8	0	0	0	111.1	S63	L61-S63 PolarHBondContact O-N 2.78Å
62	G	95.7	Very high	97.2	Very high	86 Å²	86	51.7 Å²	51.7	89%	0.887	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	2.7	-179.7	0	0	0	0	0	115.7	K60	K60-G62 PolarHBondContact O-N 2.84Å
63	S	96.1	Very high	97.4	Very high	65 Å²	65	52.4 Å²	52.4	46%	0.455	29%	0.291	S	S	.	.	S	Bend	trans	-106.9	158.4	176.7	-58.3	0	0	0	0	111.5	Q59 K60 L61	Q59-S63 VanDerWaalsContact CG-O 3.25Å; Q59-S63 WeakPolarHBondContact CG-O 3.39Å; Q59-S63 PolarHBondContact NE2-O 3.23Å; K60-S63 WeakPolarHBondContact O-CB 3.44Å; K60-S63 PolarHBondContact O-N 3.12Å; L61-S63 PolarHBondContact O-N 2.78Å
64	S	97.4	Very high	97.3	Very high	103 Å²	103	57.4 Å²	57.4	72%	0.72	32%	0.317	S	S	*	.			trans	-73.9	150.8	169.1	-58	0	0	0	0	111.1	R66	S64-R66 PolarHBondContact O-N 2.95Å
65	P	98	Very high	97.2	Very high	71 Å²	71	63 Å²	63	46%	0.461	36%	0.357	S	S	.	.			trans	-57.4	137.2	171.4	-22.1	32.4	0	0	0	111.4	Q58 Q59	Q58-P65 WeakPolarHBondContact O-CA 3.48Å; Q59-P65 HydrophobicContact CB-CB 4.34Å; Q59-P65 HydrophobicContact CB-CG 4.22Å; Q59-P65 HydrophobicContact CG-CG 4.13Å
66	R	98	Very high	97.1	Very high	109 Å²	109	64.1 Å²	64.1	41%	0.411	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	150.9	174.8	71.7	-179.4	-165.1	152.5	9.1	110.8	Y57 Q58 S64 F68	Y57-R66 CarbonylContact C-O 3.57Å; Y57-R66 WeakPolarHBondContact CA-O 3.29Å; Q58-R66 PolarHBondContact N-O 3.34Å; Q58-R66 PolarHBondContact O-N 3.07Å; S64-R66 PolarHBondContact O-N 2.95Å; R66-F68 PolarHBondContact O-N 2.89Å
67	L	98.5	Very high	97.1	Very high	57 Å²	57	68.5 Å²	68.5	30%	0.298	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	126.4	173.2	179.9	65.1	0	0	0	109.6	F55 Y57 G80	F55-L67 HydrophobicContact CB-CD1 4.48Å; F55-L67 HydrophobicContact CD1-CD1 3.94Å; Y57-L67 HydrophobicContact CE1-CB 4.45Å; Y57-L67 HydrophobicContact CE1-CD1 4.37Å; L67-G80 WeakPolarHBondContact O-CA 3.42Å
68	F	98.5	Very high	97.1	Very high	1 Å²	1	71.8 Å²	71.8	0%	0.004	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-49.4	179.9	-164.4	-114.2	0	0	0	111.2	W56 Q58 R66 G80 V83 V87 L100 I102 Y113	W56-F68 HydrophobicContact CB-CB 4.5Å; W56-F68 WeakPolarHBondContact O-CA 3.34Å; W56-F68 VanDerWaalsContact O-CB 3.32Å; W56-F68 WeakPolarHBondContact O-CB 3.45Å; W56-F68 PolarHBondContact O-N 2.88Å; Q58-F68 HydrophobicContact CB-CB 3.98Å; Q58-F68 HydrophobicContact CB-CD2 3.63Å; Q58-F68 HydrophobicContact CB-CE2 4.3Å; Q58-F68 HydrophobicContact CB-CG 3.92Å; Q58-F68 HydrophobicContact CG-CD2 4.27Å; Q58-F68 HydrophobicContact CG-CE2 4.47Å; R66-F68 PolarHBondContact O-N 2.89Å; F68-G80 PolarHBondContact O-N 2.02Å; F68-V83 HydrophobicContact CD2-CB 4.44Å; F68-V83 HydrophobicContact CD2-CG1 3.92Å; F68-V83 HydrophobicContact CD2-CG2 3.6Å; F68-V83 HydrophobicContact CE1-CG1 4.44Å; F68-V83 HydrophobicContact CE2-CB 4.45Å; F68-V83 HydrophobicContact CE2-CG1 3.69Å; F68-V83 HydrophobicContact CE2-CG2 3.99Å; F68-V83 HydrophobicContact CG-CG1 4.4Å; F68-V83 HydrophobicContact CG-CG2 4.34Å; F68-V83 HydrophobicContact CZ-CG1 3.98Å; F68-V87 HydrophobicContact CD1-CG1 3.96Å; F68-V87 HydrophobicContact CE1-CB 4.25Å; F68-V87 HydrophobicContact CE1-CG1 3.48Å; F68-V87 VanDerWaalsContact CE1-CG1 3.48Å; F68-V87 HydrophobicContact CE1-CG2 3.69Å; F68-V87 HydrophobicContact CE2-CG2 4.46Å; F68-V87 HydrophobicContact CZ-CB 4.48Å; F68-V87 HydrophobicContact CZ-CG1 4.17Å; F68-V87 HydrophobicContact CZ-CG2 3.52Å; F68-L100 HydrophobicContact CD1-CD1 3.86Å; F68-L100 HydrophobicContact CD1-CD2 3.87Å; F68-L100 HydrophobicContact CD1-CG 4.47Å; F68-L100 HydrophobicContact CE1-CD1 4.05Å; F68-L100 HydrophobicContact CE1-CD2 3.98Å; F68-L100 HydrophobicContact CE1-CG 4.45Å; F68-I102 HydrophobicContact CE1-CD1 3.86Å; F68-I102 HydrophobicContact CE1-CG1 4.2Å; F68-I102 HydrophobicContact CZ-CD1 4.11Å; F68-Y113 HydrophobicContact CD1-CD1 4.25Å; F68-Y113 AromaticContact CD1-CE1 3.73Å; F68-Y113 HydrophobicContact CD1-CE1 3.73Å; F68-Y113 HydrophobicContact CD2-CE1 4.38Å; F68-Y113 HydrophobicContact CE1-CD1 4.45Å; F68-Y113 AromaticContact CE1-CE1 3.58Å; F68-Y113 HydrophobicContact CE1-CE1 3.58Å; F68-Y113 HydrophobicContact CE2-CE1 4.26Å; F68-Y113 HydrophobicContact CG-CE1 4.13Å; F68-Y113 AromaticContact CZ-CE1 3.87Å; F68-Y113 HydrophobicContact CZ-CE1 3.87Å
69	L	98.8	Very high	97.1	Very high	2 Å²	2	74.4 Å²	74.4	1%	0.01	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	131.8	178.2	172	71.4	0	0	0	110.4	F55 W56 H71 L79 V87 S88 L100	F55-L69 CarbonylContact C-O 3.56Å; F55-L69 WeakPolarHBondContact CA-O 3.31Å; W56-L69 HydrophobicContact CB-CB 4.18Å; W56-L69 PolarHBondContact N-O 2.94Å; W56-L69 PolarHBondContact O-N 2.81Å; L69-H71 HydrophobicContact CD2-CB 4.23Å; L69-H71 HydrophobicContact CG-CB 4.21Å; L69-L79 HydrophobicContact CD1-CD2 3.82Å; L69-V87 HydrophobicContact CB-CG1 4.47Å; L69-S88 VanDerWaalsContact CD2-C 3.48Å; L69-S88 WeakPolarHBondContact CD2-O 3.46Å; L69-L100 HydrophobicContact CB-CD1 4.09Å; L69-L100 HydrophobicContact CD2-CD1 3.65Å
70	Y	98.3	Very high	97.1	Very high	35 Å²	35	72.1 Å²	72.1	14%	0.137	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.5	158.1	160.3	-100.1	0	0	0	109.1	N53 M54 F55 Y72 D76 K77 Q78	N53-Y70 HydrophobicContact CB-CE2 3.94Å; N53-Y70 WeakPolarHBondContact OD1-CE2 3.4Å; N53-Y70 PolarHBondContact OD1-OH 3.26Å; N53-Y70 VanDerWaalsContact OD1-OH 3.09Å; M54-Y70 CarbonylContact O-C 3.58Å; M54-Y70 WeakPolarHBondContact O-CA 3.49Å; F55-Y70 AromaticContact CD1-CD2 3.96Å; F55-Y70 HydrophobicContact CD1-CD2 3.96Å; F55-Y70 AromaticContact CE1-CD2 3.44Å; F55-Y70 HydrophobicContact CE1-CD2 3.44Å; F55-Y70 VanDerWaalsContact CE1-CD2 3.44Å; F55-Y70 HydrophobicContact CE1-CE2 4.25Å; F55-Y70 HydrophobicContact CE1-CG 4.16Å; F55-Y70 HydrophobicContact CE2-CD2 4.18Å; F55-Y70 HydrophobicContact CE2-CE2 4.49Å; F55-Y70 AromaticContact CZ-CD2 3.57Å; F55-Y70 HydrophobicContact CZ-CD2 3.57Å; F55-Y70 AromaticContact CZ-CE2 3.94Å; F55-Y70 HydrophobicContact CZ-CE2 3.94Å; Y70-Y72 WeakPolarHBondContact OH-CB 3.31Å; Y70-D76 WeakPolarHBondContact CE1-OD1 3.33Å; Y70-D76 PolarHBondContact OH-OD2 3.33Å; Y70-K77 CarbonylContact O-C 3.57Å; Y70-K77 VanDerWaalsContact O-CA 3.28Å; Y70-K77 WeakPolarHBondContact O-CA 3.49Å; Y70-K77 WeakPolarHBondContact O-CB 3.49Å; Y70-Q78 HydrophobicContact CD1-CB 4.02Å; Y70-Q78 PolarHBondContact N-O 2.75Å; Y70-Q78 PolarHBondContact O-N 2.81Å
71	H	97.8	Very high	97.1	Very high	8 Å²	8	73.5 Å²	73.5	4%	0.037	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	107.9	-178.7	-177.5	-74.4	0	0	0	111.7	M54 L69 G89	M54-H71 WeakPolarHBondContact CB-O 3.5Å; M54-H71 PolarHBondContact N-O 2.98Å; M54-H71 PolarHBondContact O-N 2.77Å; L69-H71 HydrophobicContact CD2-CB 4.23Å; L69-H71 HydrophobicContact CG-CB 4.21Å; H71-G89 PolarHBondContact NE2-O 2.9Å
72	Y	95.9	Very high	97.2	Very high	84 Å²	84	68.6 Å²	68.6	33%	0.329	42%	0.415	S	S	.	.	S	Bend	trans	-98	-51.5	168	-179.8	-101.1	0	0	0	111	N53 Y70 D76 K91	N53-Y72 VanDerWaalsContact OD1-CD2 3.31Å; N53-Y72 WeakPolarHBondContact OD1-CD2 3.42Å; Y70-Y72 WeakPolarHBondContact OH-CB 3.31Å; Y72-D76 HydrophobicContact CD1-CB 4.28Å; Y72-D76 PolarHBondContact N-O 2.98Å; Y72-K91 WeakPolarHBondContact O-CE 3.33Å; Y72-K91 PolarHBondContact O-NZ 2.92Å
73	S	94.9	Very high	97.3	Very high	37 Å²	37	65.1 Å²	65.1	26%	0.259	38%	0.377	S	S	.	.	S	Bend	trans	-146	177.6	176.2	73	0	0	0	0	110.9	S75 D76	S73-S75 PolarHBondContact O-N 3.03Å; S73-S75 PolarHBondContact OG-N 3.34Å; S73-S75 PolarHBondContact OG-OG 3.32Å; S73-S75 VanDerWaalsContact OG-OG 3.05Å; S73-D76 PolarHBondContact N-O 3.25Å; S73-D76 CarbonylContact O-C 3.51Å; S73-D76 VanDerWaalsContact O-C 3.25Å; S73-D76 PolarHBondContact O-N 3.17Å; S73-D76 VanDerWaalsContact O-N 3.17Å; S73-D76 VanDerWaalsContact O-O 3.04Å; S73-D76 PolarHBondContact OG-N 3.32Å; S73-D76 VanDerWaalsContact OG-N 3.15Å
74	D	94.3	Very high	97.4	Very high	122 Å²	122	64.4 Å²	64.4	65%	0.652	37%	0.371	S	S	*	.	S	Bend	trans	-63	-28.7	176.2	-84.4	-47	0	0	0	114	K77	D74-K77 WeakPolarHBondContact O-CE 3.32Å; D74-K77 PolarHBondContact O-NZ 3.24Å; D74-K77 IonicContact OD1-NZ 3.33Å; D74-K77 PolarHBondContact OD1-NZ 3.05Å
75	S	95.5	Very high	97.4	Very high	119 Å²	119	65.1 Å²	65.1	83%	0.832	38%	0.376	S	S	*	.	S	Bend	trans	-90	-15.8	176.3	61.6	0	0	0	0	113.3	S73	S73-S75 PolarHBondContact O-N 3.03Å; S73-S75 PolarHBondContact OG-N 3.34Å; S73-S75 PolarHBondContact OG-OG 3.32Å; S73-S75 VanDerWaalsContact OG-OG 3.05Å
76	D	96.2	Very high	97.4	Very high	68 Å²	68	64.2 Å²	64.2	36%	0.364	36%	0.363	S	S	.	.	S	Bend	trans	-129	84	-178.8	-175.1	21.2	0	0	0	110.5	Y70 Y72 S73	Y70-D76 WeakPolarHBondContact CE1-OD1 3.33Å; Y70-D76 PolarHBondContact OH-OD2 3.33Å; Y72-D76 HydrophobicContact CD1-CB 4.28Å; Y72-D76 PolarHBondContact N-O 2.98Å; S73-D76 PolarHBondContact N-O 3.25Å; S73-D76 CarbonylContact O-C 3.51Å; S73-D76 VanDerWaalsContact O-C 3.25Å; S73-D76 PolarHBondContact O-N 3.17Å; S73-D76 VanDerWaalsContact O-N 3.17Å; S73-D76 VanDerWaalsContact O-O 3.04Å; S73-D76 PolarHBondContact OG-N 3.32Å; S73-D76 VanDerWaalsContact OG-N 3.15Å
77	K	97	Very high	97.4	Very high	93 Å²	93	59.3 Å²	59.3	40%	0.404	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	148.1	178.8	62.3	-168.4	173.2	-157.7	0	109.9	Y70 D74	Y70-K77 CarbonylContact O-C 3.57Å; Y70-K77 VanDerWaalsContact O-CA 3.28Å; Y70-K77 WeakPolarHBondContact O-CA 3.49Å; Y70-K77 WeakPolarHBondContact O-CB 3.49Å; D74-K77 WeakPolarHBondContact O-CE 3.32Å; D74-K77 PolarHBondContact O-NZ 3.24Å; D74-K77 IonicContact OD1-NZ 3.33Å; D74-K77 PolarHBondContact OD1-NZ 3.05Å
78	Q	98.3	Very high	97.4	Very high	129 Å²	129	58.7 Å²	58.7	60%	0.603	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.4	130.3	-177.7	-173.7	175	-41.2	0	0	110.5	Y70	Y70-Q78 HydrophobicContact CD1-CB 4.02Å; Y70-Q78 PolarHBondContact N-O 2.75Å; Y70-Q78 PolarHBondContact O-N 2.81Å
79	L	98.7	Very high	97.4	Very high	60 Å²	60	58.9 Å²	58.9	31%	0.314	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	145.3	172.2	-68.5	176.3	0	0	0	110.7	L69 V83 V87	L69-L79 HydrophobicContact CD1-CD2 3.82Å; L79-V83 HydrophobicContact CB-CB 4.23Å; L79-V83 HydrophobicContact CB-CG1 4.5Å; L79-V83 HydrophobicContact CD2-CG1 3.9Å; L79-V87 HydrophobicContact CD2-CB 3.88Å; L79-V87 HydrophobicContact CD2-CG1 3.92Å
80	G	98.4	Very high	97.3	Very high	5 Å²	5	60.6 Å²	60.6	5%	0.052	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-63.4	160.6	170.5	0	0	0	0	0	112.1	L67 F68 G82 V83	L67-G80 WeakPolarHBondContact O-CA 3.42Å; F68-G80 PolarHBondContact O-N 2.02Å; G80-G82 PolarHBondContact O-N 3.47Å; G80-V83 WeakPolarHBondContact O-CB 3.38Å; G80-V83 WeakPolarHBondContact O-CG2 3.35Å; G80-V83 PolarHBondContact O-N 3.07Å; G80-V83 VanDerWaalsContact O-N 3.07Å
81	P	97.5	Very high	97.2	Very high	112 Å²	112	61.3 Å²	61.3	73%	0.727	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	125.5	177.7	-25.2	34.5	0	0	0	112.6	V83	P81-V83 PolarHBondContact O-N 2.96Å
82	G	97.2	Very high	97.2	Very high	74 Å²	74	64.7 Å²	64.7	76%	0.763	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	13	179.5	0	0	0	0	0	115	G80	G80-G82 PolarHBondContact O-N 3.47Å
83	V	98.1	Very high	97.2	Very high	13 Å²	13	65.2 Å²	65.2	8%	0.079	39%	0.392	C	S	.	.			trans	-79.7	130.1	173.6	177.3	0	0	0	0	109.5	F68 L79 G80 P81 V87	F68-V83 HydrophobicContact CD2-CB 4.44Å; F68-V83 HydrophobicContact CD2-CG1 3.92Å; F68-V83 HydrophobicContact CD2-CG2 3.6Å; F68-V83 HydrophobicContact CE1-CG1 4.44Å; F68-V83 HydrophobicContact CE2-CB 4.45Å; F68-V83 HydrophobicContact CE2-CG1 3.69Å; F68-V83 HydrophobicContact CE2-CG2 3.99Å; F68-V83 HydrophobicContact CG-CG1 4.4Å; F68-V83 HydrophobicContact CG-CG2 4.34Å; F68-V83 HydrophobicContact CZ-CG1 3.98Å; L79-V83 HydrophobicContact CB-CB 4.23Å; L79-V83 HydrophobicContact CB-CG1 4.5Å; L79-V83 HydrophobicContact CD2-CG1 3.9Å; G80-V83 WeakPolarHBondContact O-CB 3.38Å; G80-V83 WeakPolarHBondContact O-CG2 3.35Å; G80-V83 PolarHBondContact O-N 3.07Å; G80-V83 VanDerWaalsContact O-N 3.07Å; P81-V83 PolarHBondContact O-N 2.96Å; V83-V87 HydrophobicContact CG1-CB 3.91Å; V83-V87 HydrophobicContact CG1-CG1 4.2Å; V83-V87 HydrophobicContact CG1-CG2 3.7Å
84	P	97.8	Very high	97.2	Very high	50 Å²	50	68.8 Å²	68.8	33%	0.325	42%	0.417	S	S	.	.			trans	-66.1	151	-177.6	-20.5	32.1	0	0	0	113.4	R86 V87	P84-R86 HydrophobicContact CB-CG 4.11Å; P84-R86 PolarHBondContact O-N 2.79Å; P84-V87 WeakPolarHBondContact O-CB 3.46Å; P84-V87 PolarHBondContact O-N 3.21Å; P84-V87 VanDerWaalsContact O-N 3.16Å
85	S	97.7	Very high	97.3	Very high	118 Å²	118	65.1 Å²	65.1	83%	0.825	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-12	178.7	56.2	0	0	0	0	114.8	V87	S85-V87 PolarHBondContact O-N 3.06Å
86	R	97.9	Very high	97.3	Very high	52 Å²	52	60.5 Å²	60.5	20%	0.196	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-10.7	174.9	82.1	-166	177.3	-149.4	-5.9	113.6	P84 I102 S103 E108 D109	P84-R86 HydrophobicContact CB-CG 4.11Å; P84-R86 PolarHBondContact O-N 2.79Å; R86-I102 HydrophobicContact CG-CG2 4.38Å; R86-S103 VanDerWaalsContact CB-O 3.28Å; R86-S103 WeakPolarHBondContact CB-O 3.49Å; R86-S103 WeakPolarHBondContact CB-OG 3.4Å; R86-S103 WeakPolarHBondContact CD-O 3.36Å; R86-S103 WeakPolarHBondContact CG-O 3.38Å; R86-S103 PolarHBondContact O-N 3.48Å; R86-S103 PolarHBondContact O-OG 3.44Å; R86-E108 IonicContact CZ-OE1 3.87Å; R86-E108 IonicContact NH1-OE1 3.33Å; R86-E108 PolarHBondContact NH1-OE1 2.89Å; R86-E108 VanDerWaalsContact NH1-OE1 3.13Å; R86-E108 IonicContact NH2-OE1 2.89Å; R86-E108 PolarHBondContact NH2-OE1 2.82Å; R86-D109 IonicContact CZ-OD1 3.05Å; R86-D109 IonicContact CZ-OD2 2.76Å; R86-D109 IonicContact NE-OD1 2.63Å; R86-D109 IonicContact NE-OD2 3.43Å; R86-D109 PolarHBondContact NE-OD2 3.34Å; R86-D109 IonicContact NH2-OD1 3.13Å; R86-D109 PolarHBondContact NH2-OD1 2.92Å; R86-D109 IonicContact NH2-OD2 3.75Å; R86-D109 PolarHBondContact NH2-OD2 3.36Å
87	V	98.5	Very high	97.4	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.042	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.7	178.7	179.4	0	0	0	0	110.1	F68 L69 L79 V83 P84 S85 L100 L101 I102	F68-V87 HydrophobicContact CD1-CG1 3.96Å; F68-V87 HydrophobicContact CE1-CB 4.25Å; F68-V87 HydrophobicContact CE1-CG1 3.48Å; F68-V87 VanDerWaalsContact CE1-CG1 3.48Å; F68-V87 HydrophobicContact CE1-CG2 3.69Å; F68-V87 HydrophobicContact CE2-CG2 4.46Å; F68-V87 HydrophobicContact CZ-CB 4.48Å; F68-V87 HydrophobicContact CZ-CG1 4.17Å; F68-V87 HydrophobicContact CZ-CG2 3.52Å; L69-V87 HydrophobicContact CB-CG1 4.47Å; L79-V87 HydrophobicContact CD2-CB 3.88Å; L79-V87 HydrophobicContact CD2-CG1 3.92Å; V83-V87 HydrophobicContact CG1-CB 3.91Å; V83-V87 HydrophobicContact CG1-CG1 4.2Å; V83-V87 HydrophobicContact CG1-CG2 3.7Å; P84-V87 WeakPolarHBondContact O-CB 3.46Å; P84-V87 PolarHBondContact O-N 3.21Å; P84-V87 VanDerWaalsContact O-N 3.16Å; S85-V87 PolarHBondContact O-N 3.06Å; V87-L100 HydrophobicContact CG1-CD1 3.78Å; V87-L101 CarbonylContact C-O 3.59Å; V87-L101 WeakPolarHBondContact CA-O 3.4Å; V87-I102 HydrophobicContact CG2-CG1 4.4Å; V87-I102 HydrophobicContact CG2-CG2 4.34Å
88	S	98	Very high	97.4	Very high	44 Å²	44	53.2 Å²	53.2	31%	0.308	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	175.2	172.2	70.7	0	0	0	0	111.4	L69 L101	L69-S88 VanDerWaalsContact CD2-C 3.48Å; L69-S88 WeakPolarHBondContact CD2-O 3.46Å; S88-L101 PolarHBondContact N-O 2.91Å; S88-L101 PolarHBondContact O-N 3.22Å; S88-L101 WeakPolarHBondContact OG-CB 3.24Å
89	G	98	Very high	97.4	Very high	5 Å²	5	47.6 Å²	47.6	5%	0.052	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	160.9	174.9	0	0	0	0	0	110.7	H71 F99	H71-G89 PolarHBondContact NE2-O 2.9Å; G89-F99 CarbonylContact C-O 3.55Å; G89-F99 VanDerWaalsContact CA-O 3.24Å; G89-F99 WeakPolarHBondContact CA-O 3.5Å
90	S	97.5	Very high	97.4	Very high	38 Å²	38	44.8 Å²	44.8	27%	0.266	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	165.1	168.2	63.3	0	0	0	0	110	F99	S90-F99 PolarHBondContact N-O 3.22Å; S90-F99 PolarHBondContact O-N 3.24Å; S90-F99 WeakPolarHBondContact OG-CB 2.98Å
91	K	97	Very high	97.4	Very high	49 Å²	49	46.2 Å²	46.2	21%	0.213	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.8	178.6	-67	174.1	170.2	-179.2	0	109.8	V49 G50 K52 Y72 A98	V49-K91 HydrophobicContact CG1-CB 4.49Å; V49-K91 HydrophobicContact CG2-CB 4.42Å; V49-K91 HydrophobicContact CG2-CD 4.1Å; V49-K91 HydrophobicContact CG2-CG 4Å; V49-K91 WeakPolarHBondContact O-CD 2.98Å; V49-K91 WeakPolarHBondContact O-CE 3.39Å; V49-K91 PolarHBondContact O-NZ 3.29Å; G50-K91 PolarHBondContact O-NZ 2.85Å; K52-K91 PolarHBondContact O-NZ 3.46Å; Y72-K91 WeakPolarHBondContact O-CE 3.33Å; Y72-K91 PolarHBondContact O-NZ 2.92Å; K91-A98 HydrophobicContact CG-CB 4.48Å
92	E	96.8	Very high	97.5	Very high	79 Å²	79	41 Å²	41	37%	0.369	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	106.6	173.5	-173.1	170.3	-118.6	0	0	108.4	S94 S95 N96 T97 F99	E92-S94 WeakPolarHBondContact CG-OG 3.46Å; E92-S95 WeakPolarHBondContact CB-OG 3.44Å; E92-S95 VanDerWaalsContact CG-OG 3.31Å; E92-S95 WeakPolarHBondContact CG-OG 3.08Å; E92-S95 PolarHBondContact O-OG 3.08Å; E92-S95 PolarHBondContact OE2-OG 3.07Å; E92-N96 WeakPolarHBondContact O-CA 3.21Å; E92-N96 PolarHBondContact O-N 2.85Å; E92-T97 PolarHBondContact N-O 3.13Å; E92-T97 PolarHBondContact O-N 3.49Å; E92-F99 HydrophobicContact CB-CE2 3.85Å
93	T	95	Very high	97.5	Very high	96 Å²	96	39.8 Å²	39.8	59%	0.589	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-30.2	-174.4	49.7	0	0	0	0	112.7	V49 S95 N96	V49-T93 HydrophobicContact CG1-CG2 4.16Å; T93-S95 VanDerWaalsContact C-N 3.33Å; T93-S95 PolarHBondContact O-N 2.74Å; T93-N96 PolarHBondContact O-N 3.12Å
94	S	95.4	Very high	97.6	Very high	111 Å²	111	40.5 Å²	40.5	78%	0.776	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-36	177.4	53.9	0	0	0	0	112.9	E92	E92-S94 WeakPolarHBondContact CG-OG 3.46Å
95	S	96.4	Very high	97.6	Very high	45 Å²	45	39 Å²	39	32%	0.315	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	4.7	175.6	63.9	0	0	0	0	112.9	E92 T93 T97	E92-S95 WeakPolarHBondContact CB-OG 3.44Å; E92-S95 VanDerWaalsContact CG-OG 3.31Å; E92-S95 WeakPolarHBondContact CG-OG 3.08Å; E92-S95 PolarHBondContact O-OG 3.08Å; E92-S95 PolarHBondContact OE2-OG 3.07Å; T93-S95 VanDerWaalsContact C-N 3.33Å; T93-S95 PolarHBondContact O-N 2.74Å; S95-T97 PolarHBondContact O-N 3.14Å; S95-T97 VanDerWaalsContact O-N 3.12Å; S95-T97 PolarHBondContact O-OG1 3.09Å
96	N	96	Very high	97.6	Very high	22 Å²	22	37.4 Å²	37.4	12%	0.118	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	38.9	-174.9	-155.8	33.7	0	0	0	114	L43 S44 L47 S48 V49 E92 T93	L43-N96 WeakPolarHBondContact CB-ND2 3.28Å; L43-N96 PolarHBondContact N-O 2.88Å; L43-N96 PolarHBondContact O-ND2 2.91Å; S44-N96 PolarHBondContact O-ND2 3.37Å; S44-N96 VanDerWaalsContact O-ND2 3.08Å; L47-N96 PolarHBondContact O-ND2 2.54Å; L47-N96 PolarHBondContact O-OD1 2.85Å; S48-N96 WeakPolarHBondContact CA-OD1 3.18Å; V49-N96 PolarHBondContact N-OD1 3.1Å; E92-N96 WeakPolarHBondContact O-CA 3.21Å; E92-N96 PolarHBondContact O-N 2.85Å; T93-N96 PolarHBondContact O-N 3.12Å
97	T	97.6	Very high	97.5	Very high	7 Å²	7	39.6 Å²	39.6	4%	0.043	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.7	-169.5	-62.4	0	0	0	0	111	P40 C41 T42 E92 S95 F99	P40-T97 HydrophobicContact CB-CG2 3.7Å; C41-T97 WeakPolarHBondContact O-CA 3.4Å; T42-T97 PolarHBondContact OG1-OG1 2.83Å; E92-T97 PolarHBondContact N-O 3.13Å; E92-T97 PolarHBondContact O-N 3.49Å; S95-T97 PolarHBondContact O-N 3.14Å; S95-T97 VanDerWaalsContact O-N 3.12Å; S95-T97 PolarHBondContact O-OG1 3.09Å; T97-F99 HydrophobicContact CG2-CD1 4.28Å; T97-F99 HydrophobicContact CG2-CD2 4.22Å; T97-F99 HydrophobicContact CG2-CE1 3.75Å; T97-F99 HydrophobicContact CG2-CE2 3.63Å; T97-F99 HydrophobicContact CG2-CZ 3.36Å
98	A	98	Very high	97.4	Very high	2 Å²	2	43.5 Å²	43.5	2%	0.017	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	145.9	166.1	0	0	0	0	0	109.5	P40 C41 V49 M54 K91	P40-A98 CarbonylContact C-O 3.56Å; C41-A98 PolarHBondContact N-O 3.34Å; C41-A98 PolarHBondContact O-N 3.32Å; V49-A98 HydrophobicContact CG2-CB 3.91Å; M54-A98 HydrophobicContact CB-CB 4.45Å; M54-A98 HydrophobicContact CE-CB 3.81Å; M54-A98 HydrophobicContact CG-CB 3.74Å; M54-A98 HydrophobicContact SD-CB 4.11Å; K91-A98 HydrophobicContact CG-CB 4.48Å
99	F	98.5	Very high	97.4	Very high	11 Å²	11	41.9 Å²	41.9	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135.9	178.1	-60.6	-88.8	0	0	0	111.2	R38 L39 P40 G89 S90 E92 T97 L101	R38-F99 HydrophobicContact CG-CB 4.27Å; R38-F99 HydrophobicContact CG-CD1 3.49Å; R38-F99 VanDerWaalsContact CG-CD1 3.49Å; R38-F99 HydrophobicContact CG-CE1 4.14Å; R38-F99 HydrophobicContact CG-CG 4.13Å; R38-F99 VanDerWaalsContact NE-CD1 3.33Å; L39-F99 VanDerWaalsContact O-CA 3.29Å; L39-F99 WeakPolarHBondContact O-CA 3.22Å; P40-F99 HydrophobicContact CB-CD1 3.92Å; P40-F99 HydrophobicContact CB-CE1 3.64Å; G89-F99 CarbonylContact C-O 3.55Å; G89-F99 VanDerWaalsContact CA-O 3.24Å; G89-F99 WeakPolarHBondContact CA-O 3.5Å; S90-F99 PolarHBondContact N-O 3.22Å; S90-F99 PolarHBondContact O-N 3.24Å; S90-F99 WeakPolarHBondContact OG-CB 2.98Å; E92-F99 HydrophobicContact CB-CE2 3.85Å; T97-F99 HydrophobicContact CG2-CD1 4.28Å; T97-F99 HydrophobicContact CG2-CD2 4.22Å; T97-F99 HydrophobicContact CG2-CE1 3.75Å; T97-F99 HydrophobicContact CG2-CE2 3.63Å; T97-F99 HydrophobicContact CG2-CZ 3.36Å; F99-L101 HydrophobicContact CB-CD2 4.32Å
100	L	98.8	Very high	97.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128.6	159.5	179.1	68.4	0	0	0	108.5	R38 L39 W56 F68 L69 V87 I102 Y113	R38-L100 WeakPolarHBondContact CA-O 3.39Å; L39-L100 HydrophobicContact CB-CB 4.28Å; L39-L100 PolarHBondContact N-O 3.09Å; L39-L100 PolarHBondContact O-N 2.94Å; W56-L100 HydrophobicContact CB-CD1 4.25Å; W56-L100 HydrophobicContact CB-CD2 4.37Å; W56-L100 HydrophobicContact CD2-CB 3.59Å; W56-L100 HydrophobicContact CD2-CD1 4.43Å; W56-L100 HydrophobicContact CD2-CD2 4.14Å; W56-L100 HydrophobicContact CD2-CG 4.28Å; W56-L100 HydrophobicContact CE3-CB 3.83Å; W56-L100 HydrophobicContact CE3-CD2 3.93Å; W56-L100 HydrophobicContact CE3-CG 4.46Å; W56-L100 HydrophobicContact CG-CB 4.09Å; W56-L100 HydrophobicContact CG-CD1 4.05Å; W56-L100 HydrophobicContact CG-CD2 4.33Å; W56-L100 HydrophobicContact CG-CG 4.4Å; W56-L100 HydrophobicContact CH2-CB 3.98Å; W56-L100 HydrophobicContact CZ2-CB 3.79Å; W56-L100 VanDerWaalsContact CZ2-N 3.34Å; W56-L100 HydrophobicContact CZ3-CB 4.01Å; F68-L100 HydrophobicContact CD1-CD1 3.86Å; F68-L100 HydrophobicContact CD1-CD2 3.87Å; F68-L100 HydrophobicContact CD1-CG 4.47Å; F68-L100 HydrophobicContact CE1-CD1 4.05Å; F68-L100 HydrophobicContact CE1-CD2 3.98Å; F68-L100 HydrophobicContact CE1-CG 4.45Å; L69-L100 HydrophobicContact CB-CD1 4.09Å; L69-L100 HydrophobicContact CD2-CD1 3.65Å; V87-L100 HydrophobicContact CG1-CD1 3.78Å; L100-I102 HydrophobicContact CD2-CD1 4.23Å; L100-I102 HydrophobicContact CD2-CG1 4.46Å; L100-I102 HydrophobicContact CG-CG1 4.24Å; L100-Y113 HydrophobicContact CD2-CD1 3.53Å; L100-Y113 HydrophobicContact CD2-CE1 3.89Å; L100-Y113 HydrophobicContact CD2-CG 4.2Å
101	L	98.5	Very high	97.4	Very high	35 Å²	35	49.3 Å²	49.3	18%	0.183	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.4	179.4	-57.6	175.4	0	0	0	108.6	A37 R38 V87 S88 F99	A37-L101 WeakPolarHBondContact O-CA 3.33Å; R38-L101 HydrophobicContact CB-CD2 3.83Å; R38-L101 HydrophobicContact CG-CD2 3.63Å; V87-L101 CarbonylContact C-O 3.59Å; V87-L101 WeakPolarHBondContact CA-O 3.4Å; S88-L101 PolarHBondContact N-O 2.91Å; S88-L101 PolarHBondContact O-N 3.22Å; S88-L101 WeakPolarHBondContact OG-CB 3.24Å; F99-L101 HydrophobicContact CB-CD2 4.32Å
102	I	98.6	Very high	97.4	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	100.5	174.8	-51.1	178.1	0	0	0	106.5	T36 A37 F68 R86 V87 L100 L105 Y113	T36-I102 CarbonylContact C-O 3.5Å; T36-I102 VanDerWaalsContact CA-O 3.3Å; T36-I102 WeakPolarHBondContact CA-O 3.33Å; A37-I102 HydrophobicContact CB-CB 4.44Å; A37-I102 PolarHBondContact N-O 2.89Å; A37-I102 PolarHBondContact O-N 2.96Å; F68-I102 HydrophobicContact CE1-CD1 3.86Å; F68-I102 HydrophobicContact CE1-CG1 4.2Å; F68-I102 HydrophobicContact CZ-CD1 4.11Å; R86-I102 HydrophobicContact CG-CG2 4.38Å; V87-I102 HydrophobicContact CG2-CG1 4.4Å; V87-I102 HydrophobicContact CG2-CG2 4.34Å; L100-I102 HydrophobicContact CD2-CD1 4.23Å; L100-I102 HydrophobicContact CD2-CG1 4.46Å; L100-I102 HydrophobicContact CG-CG1 4.24Å; I102-L105 HydrophobicContact CB-CD2 4.16Å; I102-L105 HydrophobicContact CG2-CD2 3.95Å; I102-Y113 HydrophobicContact CD1-CE1 4Å; I102-Y113 HydrophobicContact CD1-CE2 4.35Å; I102-Y113 WeakPolarHBondContact CD1-OH 3.47Å
103	S	98.3	Very high	97.5	Very high	50 Å²	50	48.8 Å²	48.8	35%	0.35	28%	0.283	S	S	.	.			trans	-81.6	148.5	178	61.6	0	0	0	0	111	R86 L105	R86-S103 VanDerWaalsContact CB-O 3.28Å; R86-S103 WeakPolarHBondContact CB-O 3.49Å; R86-S103 WeakPolarHBondContact CB-OG 3.4Å; R86-S103 WeakPolarHBondContact CD-O 3.36Å; R86-S103 WeakPolarHBondContact CG-O 3.38Å; R86-S103 PolarHBondContact O-N 3.48Å; R86-S103 PolarHBondContact O-OG 3.44Å; S103-L105 PolarHBondContact O-N 3.47Å
104	G	98.2	Very high	97.7	Very high	28 Å²	28	48.8 Å²	48.8	29%	0.289	27%	0.273	S	S	.	.	S	Bend	trans	60.7	47.1	177.2	0	0	0	0	0	113	A35 Q106	A35-G104 PolarHBondContact O-N 3Å; A35-G104 VanDerWaalsContact O-N 3.16Å; G104-Q106 WeakPolarHBondContact O-CG 3.47Å; G104-Q106 PolarHBondContact O-N 3.07Å; G104-Q106 PolarHBondContact O-NE2 3.24Å
105	L	98.3	Very high	97.8	Very high	19 Å²	19	44.2 Å²	44.2	10%	0.099	24%	0.241	C	C	.	.			trans	-44.2	135.3	-177.2	-81.1	166.9	0	0	0	113	A31 G34 A35 A37 I102 S103 D109	A31-L105 HydrophobicContact CB-CD1 3.4Å; G34-L105 PolarHBondContact N-O 3.13Å; A35-L105 HydrophobicContact CB-CD1 4.41Å; A35-L105 WeakPolarHBondContact O-CG 3.14Å; A35-L105 PolarHBondContact O-N 3.4Å; A37-L105 HydrophobicContact CB-CD1 3.81Å; A37-L105 HydrophobicContact CB-CD2 3.82Å; A37-L105 HydrophobicContact CB-CG 4.1Å; I102-L105 HydrophobicContact CB-CD2 4.16Å; I102-L105 HydrophobicContact CG2-CD2 3.95Å; S103-L105 PolarHBondContact O-N 3.47Å; L105-D109 HydrophobicContact CD2-CB 4.06Å
106	Q	98.1	Very high	97.8	Very high	84 Å²	84	45.8 Å²	45.8	39%	0.393	24%	0.244	S	C	.	.			trans	-126	163.4	176	-59.1	-57.9	-44.2	0	0	111.3	G104 E108 D109	G104-Q106 WeakPolarHBondContact O-CG 3.47Å; G104-Q106 PolarHBondContact O-N 3.07Å; G104-Q106 PolarHBondContact O-NE2 3.24Å; Q106-E108 HydrophobicContact CB-CG 4.42Å; Q106-E108 WeakPolarHBondContact CB-OE1 3.44Å; Q106-E108 WeakPolarHBondContact CB-OE2 3.28Å; Q106-E108 WeakPolarHBondContact CG-OE1 3.42Å; Q106-E108 PolarHBondContact O-N 3.15Å; Q106-E108 VanDerWaalsContact O-N 3.14Å; Q106-D109 PolarHBondContact N-OD2 3.43Å; Q106-D109 WeakPolarHBondContact O-CB 3.44Å; Q106-D109 PolarHBondContact O-N 3.06Å
107	P	96.4	Very high	97.7	Very high	98 Å²	98	46.2 Å²	46.2	64%	0.636	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-55	-31.7	178.4	-26.9	36.3	0	0	0	114	D109 E110	P107-D109 PolarHBondContact O-N 3.17Å; P107-E110 WeakPolarHBondContact O-CB 3.39Å; P107-E110 PolarHBondContact O-N 3.29Å
108	E	96.2	Very high	97.4	Very high	89 Å²	89	51.8 Å²	51.8	42%	0.416	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-71.1	-9.3	178.1	70.6	-84.6	-175	0	0	115.1	K60 R86 Q106 E110	K60-E108 WeakPolarHBondContact CE-O 3.39Å; K60-E108 PolarHBondContact NZ-O 3.4Å; R86-E108 IonicContact CZ-OE1 3.87Å; R86-E108 IonicContact NH1-OE1 3.33Å; R86-E108 PolarHBondContact NH1-OE1 2.89Å; R86-E108 VanDerWaalsContact NH1-OE1 3.13Å; R86-E108 IonicContact NH2-OE1 2.89Å; R86-E108 PolarHBondContact NH2-OE1 2.82Å; Q106-E108 HydrophobicContact CB-CG 4.42Å; Q106-E108 WeakPolarHBondContact CB-OE1 3.44Å; Q106-E108 WeakPolarHBondContact CB-OE2 3.28Å; Q106-E108 WeakPolarHBondContact CG-OE1 3.42Å; Q106-E108 PolarHBondContact O-N 3.15Å; Q106-E108 VanDerWaalsContact O-N 3.14Å; E108-E110 VanDerWaalsContact C-N 3.31Å
109	D	97.8	Very high	96.6	Very high	10 Å²	10	57 Å²	57	5%	0.053	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-82.5	-8.8	174.4	-61.6	-40.1	0	0	0	112.3	R86 L105 Q106 P107 A111 Y113	R86-D109 IonicContact CZ-OD1 3.05Å; R86-D109 IonicContact CZ-OD2 2.76Å; R86-D109 IonicContact NE-OD1 2.63Å; R86-D109 IonicContact NE-OD2 3.43Å; R86-D109 PolarHBondContact NE-OD2 3.34Å; R86-D109 IonicContact NH2-OD1 3.13Å; R86-D109 PolarHBondContact NH2-OD1 2.92Å; R86-D109 IonicContact NH2-OD2 3.75Å; R86-D109 PolarHBondContact NH2-OD2 3.36Å; L105-D109 HydrophobicContact CD2-CB 4.06Å; Q106-D109 PolarHBondContact N-OD2 3.43Å; Q106-D109 WeakPolarHBondContact O-CB 3.44Å; Q106-D109 PolarHBondContact O-N 3.06Å; P107-D109 PolarHBondContact O-N 3.17Å; D109-A111 PolarHBondContact O-N 3.24Å; D109-A111 VanDerWaalsContact O-N 3.11Å; D109-Y113 WeakPolarHBondContact O-CE2 3.02Å; D109-Y113 PolarHBondContact O-OH 2.73Å
110	E	97.3	Very high	95.2	Very high	171 Å²	171	59.6 Å²	59.6	80%	0.799	31%	0.311	S	S	*	.			trans	-67.6	110	174.6	-170	167.2	-170.4	0	0	110.5	P107 E108	P107-E110 WeakPolarHBondContact O-CB 3.39Å; P107-E110 PolarHBondContact O-N 3.29Å; E108-E110 VanDerWaalsContact C-N 3.31Å
111	A	97.9	Very high	93.5	Very high	28 Å²	28	63.9 Å²	63.9	23%	0.231	34%	0.341	C	S	.	.	S	Bend	trans	-167.9	167.3	-174.1	0	0	0	0	0	110.6	Q58 Q59 K60 D109 Y113	Q58-A111 HydrophobicContact CG-CB 3.58Å; Q59-A111 WeakPolarHBondContact O-CB 3.39Å; K60-A111 HydrophobicContact CG-CB 4.12Å; D109-A111 PolarHBondContact O-N 3.24Å; D109-A111 VanDerWaalsContact O-N 3.11Å; A111-Y113 HydrophobicContact CB-CD2 4.5Å; A111-Y113 HydrophobicContact CB-CE2 3.93Å; A111-Y113 WeakPolarHBondContact O-CD2 3.38Å
112	D	98.3	Very high	91.5	Very high	91 Å²	91	66.7 Å²	66.7	49%	0.487	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	139.7	164.6	-62.4	-43.3	0	0	0	110	Q58 Q59 Y114	Q58-D112 CarbonylContact C-O 3.55Å; Q58-D112 WeakPolarHBondContact CA-O 3.13Å; Q59-D112 HydrophobicContact CB-CB 4.35Å; Q59-D112 PolarHBondContact N-O 2.67Å; Q59-D112 PolarHBondContact O-N 3.02Å; D112-Y114 HydrophobicContact CB-CE2 3.71Å
113	Y	98.5	Very high	88.6	Confident	25 Å²	25	77.7 Å²	77.7	10%	0.098	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.5	-179.8	-70.7	-88.5	0	0	0	111.3	Q25 L39 Y57 Q58 F68 L100 I102 D109 A111	Q25-Y113 PolarHBondContact NE2-O 2.8Å; L39-Y113 HydrophobicContact CD2-CD2 3.81Å; L39-Y113 HydrophobicContact CD2-CG 3.83Å; Y57-Y113 VanDerWaalsContact O-CA 3.31Å; Y57-Y113 WeakPolarHBondContact O-CA 3.36Å; Q58-Y113 HydrophobicContact CB-CD1 4.16Å; Q58-Y113 HydrophobicContact CB-CE1 3.83Å; Q58-Y113 HydrophobicContact CG-CD1 4.37Å; Q58-Y113 HydrophobicContact CG-CE1 3.76Å; Q58-Y113 PolarHBondContact NE2-OH 2.95Å; F68-Y113 HydrophobicContact CD1-CD1 4.25Å; F68-Y113 AromaticContact CD1-CE1 3.73Å; F68-Y113 HydrophobicContact CD1-CE1 3.73Å; F68-Y113 HydrophobicContact CD2-CE1 4.38Å; F68-Y113 HydrophobicContact CE1-CD1 4.45Å; F68-Y113 AromaticContact CE1-CE1 3.58Å; F68-Y113 HydrophobicContact CE1-CE1 3.58Å; F68-Y113 HydrophobicContact CE2-CE1 4.26Å; F68-Y113 HydrophobicContact CG-CE1 4.13Å; F68-Y113 AromaticContact CZ-CE1 3.87Å; F68-Y113 HydrophobicContact CZ-CE1 3.87Å; L100-Y113 HydrophobicContact CD2-CD1 3.53Å; L100-Y113 HydrophobicContact CD2-CE1 3.89Å; L100-Y113 HydrophobicContact CD2-CG 4.2Å; I102-Y113 HydrophobicContact CD1-CE1 4Å; I102-Y113 HydrophobicContact CD1-CE2 4.35Å; I102-Y113 WeakPolarHBondContact CD1-OH 3.47Å; D109-Y113 WeakPolarHBondContact O-CE2 3.02Å; D109-Y113 PolarHBondContact O-OH 2.73Å; A111-Y113 HydrophobicContact CB-CD2 4.5Å; A111-Y113 HydrophobicContact CB-CE2 3.93Å; A111-Y113 WeakPolarHBondContact O-CD2 3.38Å
114	Y	98.1	Very high	88.1	Confident	97 Å²	97	79.1 Å²	79.1	38%	0.38	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.4	-177.7	-54.5	-81.2	0	0	0	110.4	W56 Y57 Q59 D112	W56-Y114 CarbonylContact C-O 3.55Å; W56-Y114 WeakPolarHBondContact CA-O 3.31Å; Y57-Y114 PolarHBondContact N-O 2.63Å; Y57-Y114 PolarHBondContact O-N 3.09Å; Q59-Y114 HydrophobicContact CB-CD2 4.5Å; Q59-Y114 HydrophobicContact CB-CE2 3.9Å; D112-Y114 HydrophobicContact CB-CE2 3.71Å
115	C	97.9	Very high	87.6	Confident	14 Å²	14	81.7 Å²	81.7	10%	0.095	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	150.8	171.5	65.3	0	0	0	0	111.9	L23 Q25 C41 F55 W56	L23-C115 WeakPolarHBondContact CD1-O 3.47Å; Q25-C115 VanDerWaalsContact CD-SG 3.56Å; Q25-C115 PolarHBondContact OE1-SG 2.89Å; C41-C115 HydrophobicContact CB-CB 3.45Å; C41-C115 VanDerWaalsContact CB-CB 3.45Å; C41-C115 WeakPolarHBondContact CB-SG 3.25Å; C41-C115 WeakPolarHBondContact SG-CB 3.46Å; C41-C115 CovalentContact SG-SG 2.02Å; C41-C115 PolarHBondContact SG-SG 2.88Å; F55-C115 CarbonylContact O-C 3.59Å; F55-C115 WeakPolarHBondContact O-CA 3.28Å; W56-C115 HydrophobicContact CD2-CB 4.13Å; W56-C115 HydrophobicContact CE3-CB 3.91Å; W56-C115 HydrophobicContact CH2-CB 4Å; W56-C115 HydrophobicContact CZ2-CB 4.17Å; W56-C115 HydrophobicContact CZ3-CB 3.85Å
116	Q	96	Very high	87	Confident	79 Å²	79	85.2 Å²	85.2	37%	0.369	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.3	169.4	-176.7	-162	-59.9	0	0	108.5	F55 Y57	F55-Q116 HydrophobicContact CB-CB 4.26Å; F55-Q116 PolarHBondContact N-O 2.82Å; F55-Q116 PolarHBondContact O-N 3.18Å; Y57-Q116 HydrophobicContact CE2-CB 3.9Å; Y57-Q116 PolarHBondContact OH-OE1 3.35Å
117	V	93.9	Very high	86.3	Confident	31 Å²	31	85.3 Å²	85.3	19%	0.188	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	139.8	170.6	66.8	0	0	0	0	109.6	L23 L43 L47 K52 N53 M54	L23-V117 HydrophobicContact CD1-CG1 4.21Å; L23-V117 HydrophobicContact CD2-CB 4.24Å; L23-V117 HydrophobicContact CD2-CG1 3.88Å; L23-V117 HydrophobicContact CG-CG1 4.37Å; L43-V117 HydrophobicContact CD2-CB 4.38Å; L43-V117 HydrophobicContact CD2-CG2 3.83Å; L47-V117 HydrophobicContact CD1-CG1 4.33Å; K52-V117 HydrophobicContact CB-CG2 3.54Å; K52-V117 HydrophobicContact CD-CG2 4.2Å; K52-V117 HydrophobicContact CG-CG2 3.97Å; N53-V117 CarbonylContact O-C 3.25Å; N53-V117 WeakPolarHBondContact O-CA 3.42Å; M54-V117 HydrophobicContact CE-CB 4.19Å; M54-V117 HydrophobicContact SD-CB 4Å; M54-V117 HydrophobicContact SD-CG2 3.81Å
118	Y	91.5	Very high	85.7	Confident	124 Å²	124	84.5 Å²	84.5	49%	0.486	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.6	169.2	-176.7	-99.4	0	0	0	110.6	N53	N53-Y118 WeakPolarHBondContact CB-O 3.14Å; N53-Y118 PolarHBondContact N-O 2.79Å; N53-Y118 PolarHBondContact ND2-O 3.05Å; N53-Y118 PolarHBondContact O-N 3.18Å
119	E	81	Confident	85	Confident	111 Å²	111	84.2 Å²	84.2	52%	0.519	45%	0.454	S	S	.	.			trans	-91.7	118.3	169.8	-178.5	159	-140.6	0	0	108.6	K52 S121	K52-E119 HydrophobicContact CD-CB 3.81Å; K52-E119 HydrophobicContact CD-CG 4.17Å; K52-E119 VanDerWaalsContact CE-CD 3.49Å; K52-E119 WeakPolarHBondContact CE-OE1 3.15Å; K52-E119 IonicContact NZ-OE1 2.77Å; K52-E119 PolarHBondContact NZ-OE1 3.46Å; K52-E119 IonicContact NZ-OE2 3.66Å; E119-S121 PolarHBondContact O-N 2.87Å
120	S	69.8	Low	84.1	Confident	65 Å²	65	89.5 Å²	89.5	46%	0.455	48%	0.483	S	S	.	.			trans	-65.1	117.1	166.8	52.5	0	0	0	0	107.5	A122	S120-A122 PolarHBondContact O-N 2.99Å
121	S	63.5	Low	83.1	Confident	90 Å²	90	83.2 Å²	83.2	63%	0.629	46%	0.458	S	S	*	.			trans	-56.5	110.4	161.3	49.4	0	0	0	0	107	E119 N123	E119-S121 PolarHBondContact O-N 2.87Å; S121-N123 PolarHBondContact O-N 3.33Å
122	A	56.5	Low	81.8	Confident	94 Å²	94	87.8 Å²	87.8	78%	0.777	48%	0.477	S	S	*	.			trans	-58.5	128.7	163.5	0	0	0	0	0	106.9	S120	S120-A122 PolarHBondContact O-N 2.99Å
123	N	37.1	Very low	80.3	Confident	233 Å²	233	87.5 Å²	87.5	100%	1.246	48%	0.477	S	S	*	.			trans	-58.1	0	171.1	-76.4	-9.2	0	0	0	111.1	S121	S121-N123 PolarHBondContact O-N 3.33Å

Retrieved 123 of 123 residues in 111.3 ms (Link to these results)

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