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Probable non-functional immunoglobulin lambda variable 2-33

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 (A0A2J8IMU2), UniProt , Accession A0A075B6J2, Species HUMAN (Homo sapiens, Human), Gene IGLV2-33, Length 118 aa.

						>LV233_HUMAN|A0A075B6J2|IGLV2-33
MAWALLLLTLLTQGTGSWAQSALTQPPFVSGAPGQSVTISCTGTSSDVGDYDHVFWYQKRLSTTSRLLIYNVNTRPSGISDLFSGSKSGNMASLTISGLKSEVEANYHCSLYSSSYTF
					

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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	53.3	Low	53.5	Low	253 Å²	253	157.7 Å²	157.7	100%	1.246	85%	0.847	S	S	*	*				0	105.1	0	-79.6	173.2	-174.3	0	0	108.5
2	A	44.7	Very low	53.6	Low	99 Å²	99	154 Å²	154	82%	0.818	83%	0.834	S	S	*	*			trans	-177.9	84.9	163.7	0	0	0	0	0	105.1
3	W	48.3	Very low	53.9	Low	239 Å²	239	153.4 Å²	153.4	91%	0.905	82%	0.822	S	S	*	*				75.4	100.3	109	-150.9	-52.4	0	0	0	112.7	L5	W3-L5 PolarHBondContact O-N 3.32Å
4	A	52.5	Low	53.4	Low	80 Å²	80	147.8 Å²	147.8	66%	0.661	82%	0.819	S	S	*	*			trans	-62.1	118.8	170.1	0	0	0	0	0	110.2	L6	A4-L6 PolarHBondContact O-N 2.9Å
5	L	54.3	Low	53.4	Low	162 Å²	162	146.1 Å²	146.1	85%	0.848	81%	0.814	S	S	*	*			trans	-71.8	96.6	168.7	-70.5	169	0	0	0	108.3	W3 L7	W3-L5 PolarHBondContact O-N 3.32Å; L5-L7 PolarHBondContact O-N 3.42Å
6	L	57.1	Low	53.2	Low	151 Å²	151	140.2 Å²	140.2	79%	0.791	80%	0.797	S	S	*	*			trans	-62.8	105	162.3	-89.5	146.5	0	0	0	108	A4 L8	A4-L6 PolarHBondContact O-N 2.9Å; L6-L8 PolarHBondContact O-N 3.37Å
7	L	58.9	Low	53.2	Low	167 Å²	167	138.5 Å²	138.5	87%	0.874	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.7	119.4	166.8	-105.2	110.1	0	0	0	108.8	L5	L5-L7 PolarHBondContact O-N 3.42Å
8	L	55.3	Low	53.1	Low	163 Å²	163	144.3 Å²	144.3	85%	0.853	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-55.1	139.5	179.1	-89.5	69.5	0	0	0	111.5	L6 L10	L6-L8 PolarHBondContact O-N 3.37Å; L8-L10 PolarHBondContact O-N 3.33Å
9	T	56.9	Low	53.4	Low	126 Å²	126	141.2 Å²	141.2	77%	0.773	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-53.3	130.5	172.6	41.9	0	0	0	0	111.6	L11	T9-L11 PolarHBondContact O-N 3.47Å
10	L	51.1	Low	53.7	Low	155 Å²	155	143 Å²	143	81%	0.812	80%	0.799	S	S	*	*			trans	-67.4	99.9	173	-163.8	74.9	0	0	0	108.8	L8 T12	L8-L10 PolarHBondContact O-N 3.33Å; L10-T12 HydrophobicContact CD2-CG2 3.74Å; L10-T12 HydrophobicContact CG-CG2 3.99Å; L10-T12 PolarHBondContact O-N 3.28Å
11	L	55.7	Low	54.2	Low	140 Å²	140	138.5 Å²	138.5	73%	0.733	78%	0.777	S	S	*	*			trans	-70.2	81.2	163.3	-80.2	156.7	0	0	0	108.1	T9 Q13	T9-L11 PolarHBondContact O-N 3.47Å; L11-Q13 HydrophobicContact CB-CG 4.49Å; L11-Q13 HydrophobicContact CD2-CG 4.46Å; L11-Q13 PolarHBondContact O-N 2.89Å
12	T	54.9	Low	55.5	Low	113 Å²	113	130.4 Å²	130.4	69%	0.693	75%	0.751	S	S	*	*			trans	-75.6	79.7	154.4	55.8	0	0	0	0	106.5	L10 G14	L10-T12 HydrophobicContact CD2-CG2 3.74Å; L10-T12 HydrophobicContact CG-CG2 3.99Å; L10-T12 PolarHBondContact O-N 3.28Å; T12-G14 PolarHBondContact O-N 3.39Å
13	Q	57.5	Low	57.8	Low	146 Å²	146	127.9 Å²	127.9	68%	0.682	72%	0.723	S	S	*	*			trans	-59	101.8	154.4	-65.8	178.9	34.9	0	0	104.6	L11 T15	L11-Q13 HydrophobicContact CB-CG 4.49Å; L11-Q13 HydrophobicContact CD2-CG 4.46Å; L11-Q13 PolarHBondContact O-N 2.89Å; Q13-T15 PolarHBondContact O-N 3.22Å
14	G	46.6	Very low	60.1	Low	75 Å²	75	120.8 Å²	120.8	77%	0.773	71%	0.706	S	S	*	*			trans	-61.6	88.6	162.8	0	0	0	0	0	106.1	T12 G16	T12-G14 PolarHBondContact O-N 3.39Å; G14-G16 PolarHBondContact O-N 3.15Å
15	T	53.5	Low	62.2	Low	122 Å²	122	119.3 Å²	119.3	75%	0.748	69%	0.686	S	S	*	*			trans	-56.8	98.3	155.9	47.4	0	0	0	0	104	Q13 S17	Q13-T15 PolarHBondContact O-N 3.22Å; T15-S17 PolarHBondContact O-N 2.74Å
16	G	50.5	Low	64.3	Low	52 Å²	52	113.6 Å²	113.6	54%	0.536	66%	0.658	S	S	.	*			trans	-47.2	115.7	171.8	0	0	0	0	0	106.2	G14 W18	G14-G16 PolarHBondContact O-N 3.15Å; G16-W18 PolarHBondContact O-N 2.65Å; G16-W18 PolarHBondContact O-NE1 3.26Å
17	S	54.3	Low	66.1	Low	112 Å²	112	113.1 Å²	113.1	78%	0.783	66%	0.664	S	S	*	*			trans	-66.6	112.5	179.8	-158.4	0	0	0	0	105.6	T15 A19	T15-S17 PolarHBondContact O-N 2.74Å; S17-A19 PolarHBondContact O-N 2.9Å
18	W	51.4	Low	67.9	Low	243 Å²	243	112.6 Å²	112.6	92%	0.92	66%	0.655	S	S	*	*			trans	-71.2	71.9	174.3	-60.3	67.3	0	0	0	106.6	G16 Q20	G16-W18 PolarHBondContact O-N 2.65Å; G16-W18 PolarHBondContact O-NE1 3.26Å; W18-Q20 PolarHBondContact O-N 3.4Å
19	A	57.8	Low	69.8	Low	85 Å²	85	107.4 Å²	107.4	70%	0.702	63%	0.63	S	S	*	*			trans	-70.8	100.3	-179.8	0	0	0	0	0	107.3	S17 S21	S17-A19 PolarHBondContact O-N 2.9Å; A19-S21 PolarHBondContact O-N 3.27Å
20	Q	59.3	Low	71.7	Confident	177 Å²	177	105.6 Å²	105.6	83%	0.827	62%	0.623	S	S	*	*			trans	-53.4	133.2	161.4	-174.4	165.3	-56.5	0	0	107.6	W18 A22	W18-Q20 PolarHBondContact O-N 3.4Å; Q20-A22 PolarHBondContact O-N 3.36Å; Q20-A22 VanDerWaalsContact O-N 3.14Å
21	S	64.6	Low	73.9	Confident	49 Å²	49	99.9 Å²	99.9	34%	0.343	60%	0.601	S	S	.	*			trans	-54.8	125	-174.7	-164.9	0	0	0	0	110.8	A19 L23 D47	A19-S21 PolarHBondContact O-N 3.27Å; S21-L23 PolarHBondContact O-N 3.1Å; S21-D47 WeakPolarHBondContact CB-OD2 3.27Å; S21-D47 PolarHBondContact OG-OD2 2.81Å
22	A	81.1	Confident	75.9	Confident	83 Å²	83	95.5 Å²	95.5	69%	0.686	59%	0.585	S	S	*	*			trans	-86.7	99.1	-176.7	0	0	0	0	0	109.5	Q20	Q20-A22 PolarHBondContact O-N 3.36Å; Q20-A22 VanDerWaalsContact O-N 3.14Å
23	L	92.4	Very high	77.9	Confident	45 Å²	45	95.8 Å²	95.8	24%	0.236	59%	0.589	C	S	.	*			trans	-68.6	133.4	172.4	-60.8	174.3	0	0	0	109.9	S21 V48 L111	S21-L23 PolarHBondContact O-N 3.1Å; L23-V48 HydrophobicContact CD2-CG2 3.68Å; L23-L111 HydrophobicContact CD1-CG 4.09Å; L23-L111 HydrophobicContact CD2-CD1 3.88Å; L23-L111 HydrophobicContact CD2-CG 4.14Å
24	T	95.9	Very high	79.7	Confident	91 Å²	91	91.5 Å²	91.5	56%	0.558	58%	0.584	S	S	*	*	B	Isolated β-bridge	trans	-104.6	127.5	177.6	-58.1	0	0	0	0	110.2	C41 T42	T24-C41 WeakPolarHBondContact O-CA 3.47Å; T24-T42 PolarHBondContact N-O 3.29Å; T24-T42 PolarHBondContact O-N 3.03Å
25	Q	97.4	Very high	82.2	Confident	48 Å²	48	93.1 Å²	93.1	22%	0.224	57%	0.572	C	S	.	*			trans	-125.7	151.9	174.7	-70	-175.5	-121.6	0	0	110.3	C41 Y107 C109	Q25-C41 HydrophobicContact CG-CB 4.35Å; Q25-Y107 PolarHBondContact NE2-O 2.84Å; Q25-C109 PolarHBondContact OE1-SG 2.77Å
26	P	97.7	Very high	84.3	Confident	42 Å²	42	90.9 Å²	90.9	27%	0.273	56%	0.561	S	S	.	*			trans	-62.3	143.1	170	27.7	-33.5	0	0	0	109.9	F28 V29 I39 S40	P26-F28 PolarHBondContact O-N 3.25Å; P26-V29 HydrophobicContact CB-CG2 4.22Å; P26-V29 HydrophobicContact CG-CG2 3.76Å; P26-I39 HydrophobicContact CG-CG2 4.17Å; P26-S40 VanDerWaalsContact CD-O 3.26Å; P26-S40 WeakPolarHBondContact CD-O 3.46Å
27	P	95.6	Very high	86.6	Confident	141 Å²	141	89.3 Å²	89.3	92%	0.916	54%	0.541	S	S	*	.	S	Bend	trans	-68.2	-27.2	-179.1	27.6	-34.9	0	0	0	112.5
28	F	95.7	Very high	88.7	Confident	157 Å²	157	87.5 Å²	87.5	69%	0.689	53%	0.525	S	S	*	.			trans	-156.9	149	-179.7	-178.2	-105.4	0	0	0	111	P26 S30	P26-F28 PolarHBondContact O-N 3.25Å; F28-S30 VanDerWaalsContact CE1-CB 3.47Å
29	V	96.9	Very high	90.9	Very high	54 Å²	54	76.6 Å²	76.6	33%	0.327	48%	0.484	S	S	.	.			trans	-139.6	138.4	171.9	-176.6	0	0	0	0	108	P26 V37 I39	P26-V29 HydrophobicContact CB-CG2 4.22Å; P26-V29 HydrophobicContact CG-CG2 3.76Å; V29-V37 HydrophobicContact CG1-CB 3.8Å; V29-V37 HydrophobicContact CG1-CG1 4.05Å; V29-V37 HydrophobicContact CG1-CG2 4.41Å; V29-I39 HydrophobicContact CG2-CG1 4.33Å
30	S	96.7	Very high	92.8	Very high	88 Å²	88	74.4 Å²	74.4	62%	0.615	46%	0.464	S	S	*	.			trans	-134.3	162.7	175.3	56	0	0	0	0	111.9	F28 V37	F28-S30 VanDerWaalsContact CE1-CB 3.47Å; S30-V37 WeakPolarHBondContact O-CG1 3.4Å
31	G	96.4	Very high	94.7	Very high	35 Å²	35	66 Å²	66	36%	0.361	43%	0.425	S	S	.	.			trans	-162.8	165.1	173.2	0	0	0	0	0	110.7
32	A	96.9	Very high	96.2	Very high	47 Å²	47	65.5 Å²	65.5	39%	0.388	42%	0.42	S	S	.	.			trans	-76.9	157.7	176.8	0	0	0	0	0	111.5	G34 Q35	A32-G34 PolarHBondContact O-N 3.14Å; A32-Q35 HydrophobicContact CB-CG 4.12Å; A32-Q35 VanDerWaalsContact O-CB 3.32Å; A32-Q35 WeakPolarHBondContact O-CB 3.41Å; A32-Q35 PolarHBondContact O-N 3.45Å
33	P	97	Very high	96.7	Very high	119 Å²	119	62.1 Å²	62.1	77%	0.773	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	134.9	173.9	-27.2	35.5	0	0	0	112.3	Q35 L99	P33-Q35 PolarHBondContact O-N 3.1Å; P33-L99 WeakPolarHBondContact CA-O 3.26Å
34	G	96.6	Very high	96.7	Very high	57 Å²	57	62.9 Å²	62.9	59%	0.588	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-13.8	-177.6	0	0	0	0	0	115.6	A32 L99	A32-G34 PolarHBondContact O-N 3.14Å; G34-L99 PolarHBondContact N-O 2.83Å
35	Q	97.9	Very high	96.4	Very high	109 Å²	109	62.5 Å²	62.5	51%	0.509	40%	0.4	S	S	.	.			trans	-73.1	168.7	173.5	-67.9	-170.7	-40.3	0	0	111.9	A32 P33 G98 L99	A32-Q35 HydrophobicContact CB-CG 4.12Å; A32-Q35 VanDerWaalsContact O-CB 3.32Å; A32-Q35 WeakPolarHBondContact O-CB 3.41Å; A32-Q35 PolarHBondContact O-N 3.45Å; P33-Q35 PolarHBondContact O-N 3.1Å; Q35-G98 PolarHBondContact O-N 2.5Å; Q35-G98 VanDerWaalsContact O-N 3.14Å; Q35-L99 WeakPolarHBondContact O-CG 3.48Å; Q35-L99 PolarHBondContact O-N 2.96Å
36	S	97.9	Very high	96	Very high	74 Å²	74	63.7 Å²	63.7	52%	0.517	41%	0.414	S	S	.	.			trans	-107.3	143.8	169.2	-55.4	0	0	0	0	110.1	I96 S97	S36-I96 CarbonylContact C-O 3.58Å; S36-I96 VanDerWaalsContact CA-O 3.23Å; S36-I96 WeakPolarHBondContact CA-O 3.35Å; S36-S97 WeakPolarHBondContact OG-CA 3.48Å
37	V	98.3	Very high	95.5	Very high	20 Å²	20	62.4 Å²	62.4	12%	0.121	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154	172.6	-68.2	0	0	0	0	110.1	V29 S30 T95 I96 L99	V29-V37 HydrophobicContact CG1-CB 3.8Å; V29-V37 HydrophobicContact CG1-CG1 4.05Å; V29-V37 HydrophobicContact CG1-CG2 4.41Å; S30-V37 WeakPolarHBondContact O-CG1 3.4Å; V37-T95 WeakPolarHBondContact O-CA 3.44Å; V37-I96 HydrophobicContact CG2-CB 4.07Å; V37-I96 PolarHBondContact N-O 2.98Å; V37-I96 PolarHBondContact O-N 3.27Å; V37-L99 HydrophobicContact CG1-CD1 3.66Å; V37-L99 HydrophobicContact CG2-CD1 4.15Å; V37-L99 HydrophobicContact CG2-CD2 3.86Å; V37-L99 HydrophobicContact CG2-CG 4.28Å
38	T	98.4	Very high	95.4	Very high	73 Å²	73	55.7 Å²	55.7	45%	0.448	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.8	177.1	-62	0	0	0	0	109.7	L94 T95	T38-L94 CarbonylContact C-O 3.53Å; T38-L94 WeakPolarHBondContact CA-O 3.27Å; T38-T95 PolarHBondContact OG1-OG1 3.47Å; T38-T95 VanDerWaalsContact OG1-OG1 3.06Å
39	I	98.6	Very high	95.2	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.072	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.8	173.9	-51.1	178.7	0	0	0	107.1	P26 V29 W56 S93 L94 I96 Y107	P26-I39 HydrophobicContact CG-CG2 4.17Å; V29-I39 HydrophobicContact CG2-CG1 4.33Å; I39-W56 HydrophobicContact CB-CH2 4.13Å; I39-W56 HydrophobicContact CB-CZ3 4.16Å; I39-W56 HydrophobicContact CG2-CH2 3.92Å; I39-W56 HydrophobicContact CG2-CZ3 3.82Å; I39-W56 VanDerWaalsContact O-CH2 3.27Å; I39-W56 WeakPolarHBondContact O-CH2 3.39Å; I39-S93 CarbonylContact O-C 3.58Å; I39-S93 WeakPolarHBondContact O-CA 3.49Å; I39-L94 HydrophobicContact CD1-CD2 4.45Å; I39-L94 PolarHBondContact N-O 3.31Å; I39-L94 PolarHBondContact O-N 3.05Å; I39-I96 HydrophobicContact CD1-CD1 4.14Å; I39-Y107 HydrophobicContact CD1-CD1 4.46Å; I39-Y107 HydrophobicContact CD1-CD2 3.65Å; I39-Y107 HydrophobicContact CD1-CE2 4.45Å; I39-Y107 HydrophobicContact CD1-CG 3.65Å
40	S	98.3	Very high	94.9	Very high	40 Å²	40	52 Å²	52	28%	0.28	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	150.9	176.8	54.3	0	0	0	0	111.7	P26 A92	P26-S40 VanDerWaalsContact CD-O 3.26Å; P26-S40 WeakPolarHBondContact CD-O 3.46Å; S40-A92 WeakPolarHBondContact CA-O 3.49Å
41	C	97.4	Very high	94.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	108.8	171.2	176.1	0	0	0	0	108.3	T24 Q25 W56 A92 C109	T24-C41 WeakPolarHBondContact O-CA 3.47Å; Q25-C41 HydrophobicContact CG-CB 4.35Å; C41-W56 HydrophobicContact CB-CH2 3.7Å; C41-W56 HydrophobicContact CB-CZ2 3.7Å; C41-A92 HydrophobicContact CB-CB 4.33Å; C41-A92 PolarHBondContact N-O 2.91Å; C41-A92 PolarHBondContact O-N 2.92Å; C41-C109 HydrophobicContact CB-CB 3.49Å; C41-C109 VanDerWaalsContact CB-CB 3.49Å; C41-C109 WeakPolarHBondContact CB-SG 3.21Å; C41-C109 WeakPolarHBondContact SG-CB 3.34Å; C41-C109 CovalentContact SG-SG 2.02Å; C41-C109 PolarHBondContact SG-SG 2.93Å
42	T	96.5	Very high	94.3	Very high	39 Å²	39	56.1 Å²	56.1	24%	0.239	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.8	-175.6	-51.7	0	0	0	0	110.1	T24	T24-T42 PolarHBondContact N-O 3.29Å; T24-T42 PolarHBondContact O-N 3.03Å
43	G	93.1	Very high	94	Very high	11 Å²	11	57.4 Å²	57.4	11%	0.113	35%	0.349	C	S	.	.			trans	-117.5	-160.6	170.2	0	0	0	0	0	112.1	D47 N90	G43-D47 WeakPolarHBondContact CA-OD1 3.39Å; G43-N90 PolarHBondContact N-O 3.12Å; G43-N90 PolarHBondContact O-ND2 2.88Å
44	T	91.6	Very high	94	Very high	61 Å²	61	51.8 Å²	51.8	37%	0.374	31%	0.312	S	S	.	.			trans	-83.8	177.4	166.2	73.1	0	0	0	0	112.3	S46 D47 G49 N90	T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact OG1-N 3.06Å; T44-S46 PolarHBondContact OG1-OG 3.13Å; T44-D47 VanDerWaalsContact CA-OD1 3.22Å; T44-D47 WeakPolarHBondContact CA-OD1 3.14Å; T44-D47 PolarHBondContact N-OD1 2.96Å; T44-D47 VanDerWaalsContact OG1-CG 3.32Å; T44-D47 PolarHBondContact OG1-N 2.72Å; T44-D47 PolarHBondContact OG1-OD1 2.8Å; T44-G49 PolarHBondContact O-N 2.58Å; T44-N90 WeakPolarHBondContact O-CB 3.19Å
45	S	90.1	Very high	94	Very high	83 Å²	83	50.7 Å²	50.7	58%	0.58	29%	0.291	S	S	*	.	I	π-helix	trans	-65.7	-38.2	169.8	54.6	0	0	0	0	111.5	D47 G49 D50	S45-D47 VanDerWaalsContact C-N 3.27Å; S45-D47 PolarHBondContact O-N 2.95Å; S45-G49 CarbonylContact O-C 3.4Å; S45-G49 WeakPolarHBondContact O-CA 3.42Å; S45-G49 PolarHBondContact O-N 3.25Å; S45-D50 PolarHBondContact O-N 3.06Å
46	S	88.3	Confident	94	Very high	73 Å²	73	45.5 Å²	45.5	51%	0.51	27%	0.267	S	S	.	.	I	π-helix	trans	-79.1	-1.1	-173.6	62.8	0	0	0	0	114.9	T44 D50 Y51	T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact OG1-N 3.06Å; T44-S46 PolarHBondContact OG1-OG 3.13Å; S46-D50 WeakPolarHBondContact CA-OD2 3.42Å; S46-Y51 WeakPolarHBondContact O-CE2 3.32Å
47	D	88.4	Confident	93.9	Very high	15 Å²	15	45.3 Å²	45.3	8%	0.08	26%	0.256	C	S	.	.	I	π-helix	trans	-122.6	-74	-177.1	74	-19.4	0	0	0	112.5	S21 G43 T44 S45 Y51 L111	S21-D47 WeakPolarHBondContact CB-OD2 3.27Å; S21-D47 PolarHBondContact OG-OD2 2.81Å; G43-D47 WeakPolarHBondContact CA-OD1 3.39Å; T44-D47 VanDerWaalsContact CA-OD1 3.22Å; T44-D47 WeakPolarHBondContact CA-OD1 3.14Å; T44-D47 PolarHBondContact N-OD1 2.96Å; T44-D47 VanDerWaalsContact OG1-CG 3.32Å; T44-D47 PolarHBondContact OG1-N 2.72Å; T44-D47 PolarHBondContact OG1-OD1 2.8Å; S45-D47 VanDerWaalsContact C-N 3.27Å; S45-D47 PolarHBondContact O-N 2.95Å; D47-Y51 WeakPolarHBondContact O-CD2 3.45Å; D47-L111 HydrophobicContact CB-CD1 3.48Å; D47-L111 VanDerWaalsContact CB-CD1 3.48Å
48	V	91.9	Very high	93.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-74	-39.2	174.8	178	0	0	0	0	109.3	L23 V54 K87 N90 A92 L111	L23-V48 HydrophobicContact CD2-CG2 3.68Å; V48-V54 HydrophobicContact CG1-CG2 4.14Å; V48-K87 HydrophobicContact CG1-CD 3.88Å; V48-K87 HydrophobicContact CG1-CG 4.26Å; V48-K87 WeakPolarHBondContact O-CD 3.2Å; V48-K87 PolarHBondContact O-NZ 3.28Å; V48-N90 VanDerWaalsContact CG1-C 3.42Å; V48-N90 WeakPolarHBondContact CG1-O 3.41Å; V48-A92 HydrophobicContact CG1-CB 4.22Å; V48-L111 HydrophobicContact CG2-CD1 4.14Å; V48-L111 HydrophobicContact CG2-CD2 4.02Å; V48-L111 HydrophobicContact CG2-CG 4.48Å
49	G	91.6	Very high	93.6	Very high	21 Å²	21	46.6 Å²	46.6	22%	0.216	25%	0.253	C	S	.	.	I	π-helix	trans	-61.2	-58.8	-176.7	0	0	0	0	0	113	T44 S45 K87 G89	T44-G49 PolarHBondContact O-N 2.58Å; S45-G49 CarbonylContact O-C 3.4Å; S45-G49 WeakPolarHBondContact O-CA 3.42Å; S45-G49 PolarHBondContact O-N 3.25Å; G49-K87 PolarHBondContact O-NZ 2.97Å; G49-G89 WeakPolarHBondContact CA-O 3.23Å
50	D	91.2	Very high	93.2	Very high	114 Å²	114	50.6 Å²	50.6	61%	0.61	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-20.8	-170.1	-71.3	-13.7	0	0	0	113.8	S45 S46	S45-D50 PolarHBondContact O-N 3.06Å; S46-D50 WeakPolarHBondContact CA-OD2 3.42Å
51	Y	88.1	Confident	92.5	Very high	112 Å²	112	56.1 Å²	56.1	44%	0.439	29%	0.293	S	S	.	.			trans	-120.2	146.9	-175.6	-56.2	-76.5	0	0	0	112.8	S46 D47 H53 K87	S46-Y51 WeakPolarHBondContact O-CE2 3.32Å; D47-Y51 WeakPolarHBondContact O-CD2 3.45Å; Y51-H53 VanDerWaalsContact C-N 3.29Å; Y51-H53 PolarHBondContact O-N 2.8Å; Y51-K87 PolarHBondContact O-NZ 2.86Å
52	D	91.7	Very high	91.5	Very high	97 Å²	97	62.6 Å²	62.6	52%	0.519	34%	0.339	S	S	.	.			trans	-97.7	37.8	173.1	-69.1	-26.3	0	0	0	111.5	N71 V72 K87	D52-N71 CarbonylContact O-C 3.58Å; D52-N71 WeakPolarHBondContact O-CA 3.36Å; D52-V72 HydrophobicContact CB-CG2 4.06Å; D52-K87 WeakPolarHBondContact OD1-CE 3.07Å; D52-K87 IonicContact OD1-NZ 2.68Å; D52-K87 PolarHBondContact OD1-NZ 3.3Å
53	H	92.2	Very high	90.7	Very high	74 Å²	74	64 Å²	64	34%	0.343	35%	0.347	S	S	.	.			trans	-112.4	47.3	-176.7	-61.9	-50	0	0	0	112.6	Y51 F55 N71 L111 Y112	Y51-H53 VanDerWaalsContact C-N 3.29Å; Y51-H53 PolarHBondContact O-N 2.8Å; H53-F55 HydrophobicContact CB-CE2 4.16Å; H53-F55 VanDerWaalsContact O-CD2 3.27Å; H53-F55 WeakPolarHBondContact O-CD2 3.1Å; H53-F55 WeakPolarHBondContact O-CE2 3.18Å; H53-N71 PolarHBondContact ND1-OD1 2.88Å; H53-L111 WeakPolarHBondContact O-CA 3.21Å; H53-Y112 PolarHBondContact O-N 2.95Å; H53-Y112 VanDerWaalsContact O-N 3.13Å
54	V	95.3	Very high	90.4	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.6	172.3	-173.9	0	0	0	0	109.9	V48 N71 V72 A92 C109 S110 L111	V48-V54 HydrophobicContact CG1-CG2 4.14Å; V54-N71 PolarHBondContact O-N 2.96Å; V54-V72 HydrophobicContact CB-CG2 4.14Å; V54-V72 HydrophobicContact CG2-CG2 4.16Å; V54-V72 PolarHBondContact O-N 2.84Å; V54-A92 HydrophobicContact CB-CB 4.2Å; V54-A92 HydrophobicContact CG1-CB 3.71Å; V54-A92 HydrophobicContact CG2-CB 3.96Å; V54-C109 HydrophobicContact CG1-CB 4.48Å; V54-S110 WeakPolarHBondContact CA-O 3.45Å; V54-L111 HydrophobicContact CB-CD2 4.38Å; V54-L111 HydrophobicContact CG2-CD2 3.64Å
55	F	97.3	Very high	90.3	Very high	34 Å²	34	70 Å²	70	15%	0.149	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.4	178.4	-57.8	-102.5	0	0	0	109.6	H53 Y57 L67 I69 C109 S110	H53-F55 HydrophobicContact CB-CE2 4.16Å; H53-F55 VanDerWaalsContact O-CD2 3.27Å; H53-F55 WeakPolarHBondContact O-CD2 3.1Å; H53-F55 WeakPolarHBondContact O-CE2 3.18Å; F55-Y57 HydrophobicContact CB-CD2 4.4Å; F55-Y57 HydrophobicContact CB-CE2 3.56Å; F55-L67 HydrophobicContact CB-CD1 4.16Å; F55-L67 HydrophobicContact CD1-CD1 4.03Å; F55-I69 CarbonylContact C-O 3.6Å; F55-I69 VanDerWaalsContact CA-O 3.3Å; F55-I69 WeakPolarHBondContact CA-O 3.36Å; F55-C109 CarbonylContact O-C 3.53Å; F55-C109 WeakPolarHBondContact O-CA 3.29Å; F55-S110 PolarHBondContact N-O 2.96Å; F55-S110 PolarHBondContact O-N 2.83Å
56	W	98.1	Very high	90.6	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.5	174.5	-72.7	96.8	0	0	0	110.7	I39 C41 L68 I69 L94 C109	I39-W56 HydrophobicContact CB-CH2 4.13Å; I39-W56 HydrophobicContact CB-CZ3 4.16Å; I39-W56 HydrophobicContact CG2-CH2 3.92Å; I39-W56 HydrophobicContact CG2-CZ3 3.82Å; I39-W56 VanDerWaalsContact O-CH2 3.27Å; I39-W56 WeakPolarHBondContact O-CH2 3.39Å; C41-W56 HydrophobicContact CB-CH2 3.7Å; C41-W56 HydrophobicContact CB-CZ2 3.7Å; W56-L68 HydrophobicContact CB-CB 4.44Å; W56-L68 PolarHBondContact O-N 3.03Å; W56-I69 HydrophobicContact CB-CB 4.12Å; W56-I69 HydrophobicContact CG-CB 4.46Å; W56-I69 PolarHBondContact N-O 2.81Å; W56-I69 PolarHBondContact O-N 3.01Å; W56-L94 HydrophobicContact CB-CD1 4.3Å; W56-L94 HydrophobicContact CB-CD2 4.33Å; W56-L94 HydrophobicContact CD2-CB 3.48Å; W56-L94 VanDerWaalsContact CD2-CB 3.48Å; W56-L94 HydrophobicContact CD2-CD2 4.08Å; W56-L94 HydrophobicContact CD2-CG 4.24Å; W56-L94 HydrophobicContact CE3-CB 3.69Å; W56-L94 HydrophobicContact CE3-CD2 3.78Å; W56-L94 HydrophobicContact CE3-CG 4.34Å; W56-L94 HydrophobicContact CG-CB 3.98Å; W56-L94 HydrophobicContact CG-CD1 4.19Å; W56-L94 HydrophobicContact CG-CD2 4.32Å; W56-L94 HydrophobicContact CG-CG 4.41Å; W56-L94 HydrophobicContact CH2-CB 3.95Å; W56-L94 HydrophobicContact CZ2-CB 3.76Å; W56-L94 HydrophobicContact CZ3-CB 3.92Å; W56-L94 HydrophobicContact CZ3-CD2 4.38Å; W56-C109 HydrophobicContact CD2-CB 4.14Å; W56-C109 HydrophobicContact CE3-CB 4.01Å; W56-C109 HydrophobicContact CH2-CB 4.04Å; W56-C109 HydrophobicContact CZ2-CB 4.16Å; W56-C109 HydrophobicContact CZ3-CB 3.96Å
57	Y	96.7	Very high	91	Very high	71 Å²	71	70.6 Å²	70.6	28%	0.278	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.3	178.7	-61	-91.6	0	0	0	111.3	F55 R66 L67 Y107 H108 S110	F55-Y57 HydrophobicContact CB-CD2 4.4Å; F55-Y57 HydrophobicContact CB-CE2 3.56Å; Y57-R66 CarbonylContact C-O 3.53Å; Y57-R66 VanDerWaalsContact CA-O 3.27Å; Y57-R66 WeakPolarHBondContact CA-O 3.47Å; Y57-L67 HydrophobicContact CD1-CB 4.2Å; Y57-L67 HydrophobicContact CD1-CD1 4.19Å; Y57-L67 HydrophobicContact CE1-CB 4Å; Y57-L67 HydrophobicContact CE1-CD1 3.7Å; Y57-L67 HydrophobicContact CE1-CG 4.44Å; Y57-L67 HydrophobicContact CE2-CD1 4.35Å; Y57-Y107 WeakPolarHBondContact O-CA 3.35Å; Y57-H108 PolarHBondContact N-O 2.83Å; Y57-H108 PolarHBondContact O-N 3.32Å; Y57-S110 WeakPolarHBondContact CE2-OG 3.14Å
58	Q	96.4	Very high	91.4	Very high	7 Å²	7	69.9 Å²	69.9	3%	0.033	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.9	168.2	-169.9	-179.2	44	0	0	109.7	S65 R66 L68 A105 N106 Y107	Q58-S65 WeakPolarHBondContact O-CA 3.39Å; Q58-R66 PolarHBondContact N-O 2.81Å; Q58-R66 PolarHBondContact O-N 2.88Å; Q58-L68 HydrophobicContact CB-CD1 3.87Å; Q58-L68 HydrophobicContact CB-CD2 3.89Å; Q58-L68 HydrophobicContact CB-CG 3.95Å; Q58-A105 HydrophobicContact CG-CB 3.49Å; Q58-A105 VanDerWaalsContact CG-CB 3.49Å; Q58-N106 CarbonylContact C-O 3.6Å; Q58-Y107 HydrophobicContact CB-CD1 4.34Å; Q58-Y107 HydrophobicContact CB-CE1 4.07Å; Q58-Y107 HydrophobicContact CG-CD1 4.37Å; Q58-Y107 HydrophobicContact CG-CE1 3.8Å; Q58-Y107 PolarHBondContact NE2-OH 3.32Å
59	K	92.8	Very high	91.7	Very high	112 Å²	112	69.9 Å²	69.9	49%	0.487	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	115.3	171.3	-173.1	174.5	-177.2	177.3	0	109.9	N106	K59-N106 HydrophobicContact CB-CB 4.43Å; K59-N106 PolarHBondContact N-O 3.46Å; K59-N106 PolarHBondContact O-N 2.77Å
60	R	89.8	Confident	92	Very high	99 Å²	99	72.9 Å²	72.9	37%	0.374	37%	0.368	S	S	.	.			trans	-93.3	158.6	167.6	-62.9	-179.5	-179	146.1	-1.2	109.5	S62 T63 E102 A105	R60-S62 PolarHBondContact O-N 2.88Å; R60-T63 VanDerWaalsContact C-OG1 3.29Å; R60-T63 WeakPolarHBondContact CA-OG1 3.37Å; R60-T63 HydrophobicContact CB-CG2 4.1Å; R60-T63 WeakPolarHBondContact CB-OG1 3.31Å; R60-T63 PolarHBondContact N-OG1 3.04Å; R60-T63 PolarHBondContact O-N 2.8Å; R60-T63 VanDerWaalsContact O-N 3.12Å; R60-T63 PolarHBondContact O-OG1 2.84Å; R60-E102 PolarHBondContact NE-O 3.32Å; R60-E102 PolarHBondContact NH2-O 2.75Å; R60-A105 HydrophobicContact CG-CB 3.95Å
61	L	84	Confident	92.2	Very high	156 Å²	156	70.4 Å²	70.4	82%	0.817	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	132.6	177.3	-64.9	174.3	0	0	0	110.4	T63	L61-T63 PolarHBondContact O-N 3.25Å; L61-T63 VanDerWaalsContact O-N 3.13Å
62	S	77.2	Confident	92.7	Very high	136 Å²	136	65.6 Å²	65.6	95%	0.951	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	18.9	179.3	-51.1	0	0	0	0	116.1	R60	R60-S62 PolarHBondContact O-N 2.88Å
63	T	79.2	Confident	93	Very high	69 Å²	69	66.1 Å²	66.1	42%	0.423	34%	0.34	S	S	.	.	S	Bend	trans	-114	152.2	177.2	63.7	0	0	0	0	112.7	R60 L61	R60-T63 VanDerWaalsContact C-OG1 3.29Å; R60-T63 WeakPolarHBondContact CA-OG1 3.37Å; R60-T63 HydrophobicContact CB-CG2 4.1Å; R60-T63 WeakPolarHBondContact CB-OG1 3.31Å; R60-T63 PolarHBondContact N-OG1 3.04Å; R60-T63 PolarHBondContact O-N 2.8Å; R60-T63 VanDerWaalsContact O-N 3.12Å; R60-T63 PolarHBondContact O-OG1 2.84Å; L61-T63 PolarHBondContact O-N 3.25Å; L61-T63 VanDerWaalsContact O-N 3.13Å
64	T	86.4	Confident	93.2	Very high	130 Å²	130	64.9 Å²	64.9	80%	0.798	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-63.8	138.4	166.7	-52.5	0	0	0	0	109.8	R66	T64-R66 PolarHBondContact O-N 3.45Å
65	S	90.8	Very high	93.4	Very high	66 Å²	66	69.7 Å²	69.7	46%	0.462	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-53.9	127.5	173.6	-61.8	0	0	0	0	110.6	Q58	Q58-S65 WeakPolarHBondContact O-CA 3.39Å
66	R	94.5	Very high	93.4	Very high	116 Å²	116	69.5 Å²	69.5	44%	0.438	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.8	179	-174.3	-179.2	-172.6	-172.5	2.2	109.9	Y57 Q58 T64 G78 I79	Y57-R66 CarbonylContact C-O 3.53Å; Y57-R66 VanDerWaalsContact CA-O 3.27Å; Y57-R66 WeakPolarHBondContact CA-O 3.47Å; Q58-R66 PolarHBondContact N-O 2.81Å; Q58-R66 PolarHBondContact O-N 2.88Å; T64-R66 PolarHBondContact O-N 3.45Å; R66-G78 PolarHBondContact NH2-O 2.99Å; R66-I79 HydrophobicContact CG-CD1 4.19Å
67	L	96.6	Very high	93.4	Very high	54 Å²	54	75.7 Å²	75.7	28%	0.283	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.7	172.8	-179.6	66.8	0	0	0	110.2	F55 Y57 I69 Y70 P76 I79	F55-L67 HydrophobicContact CB-CD1 4.16Å; F55-L67 HydrophobicContact CD1-CD1 4.03Å; Y57-L67 HydrophobicContact CD1-CB 4.2Å; Y57-L67 HydrophobicContact CD1-CD1 4.19Å; Y57-L67 HydrophobicContact CE1-CB 4Å; Y57-L67 HydrophobicContact CE1-CD1 3.7Å; Y57-L67 HydrophobicContact CE1-CG 4.44Å; Y57-L67 HydrophobicContact CE2-CD1 4.35Å; L67-I69 WeakPolarHBondContact CD1-O 3.39Å; L67-Y70 HydrophobicContact CD2-CD1 4.47Å; L67-P76 HydrophobicContact CD2-CG 3.92Å; L67-P76 HydrophobicContact CG-CG 4.02Å; L67-I79 WeakPolarHBondContact O-CD1 3.2Å
68	L	98.1	Very high	93.3	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-46.6	178.4	-58.4	179.7	0	0	0	112.4	W56 Q58 P76 I79 F83 L94 Y107	W56-L68 HydrophobicContact CB-CB 4.44Å; W56-L68 PolarHBondContact O-N 3.03Å; Q58-L68 HydrophobicContact CB-CD1 3.87Å; Q58-L68 HydrophobicContact CB-CD2 3.89Å; Q58-L68 HydrophobicContact CB-CG 3.95Å; L68-P76 WeakPolarHBondContact O-CD 3.34Å; L68-I79 HydrophobicContact CD2-CD1 4.42Å; L68-I79 HydrophobicContact CD2-CG2 4.27Å; L68-F83 HydrophobicContact CD1-CD1 3.84Å; L68-F83 HydrophobicContact CD1-CE1 3.96Å; L68-F83 HydrophobicContact CD1-CG 4.37Å; L68-F83 HydrophobicContact CD2-CD2 4.39Å; L68-F83 HydrophobicContact CD2-CE2 4.34Å; L68-F83 HydrophobicContact CD2-CZ 4.44Å; L68-L94 HydrophobicContact CD1-CD2 4.01Å; L68-Y107 HydrophobicContact CD1-CD1 3.75Å; L68-Y107 HydrophobicContact CD1-CE1 3.59Å
69	I	98.5	Very high	93.3	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.7	-177.3	-56	-67.8	0	0	0	108	F55 W56 L67 V72 T74 R75 L94	F55-I69 CarbonylContact C-O 3.6Å; F55-I69 VanDerWaalsContact CA-O 3.3Å; F55-I69 WeakPolarHBondContact CA-O 3.36Å; W56-I69 HydrophobicContact CB-CB 4.12Å; W56-I69 HydrophobicContact CG-CB 4.46Å; W56-I69 PolarHBondContact N-O 2.81Å; W56-I69 PolarHBondContact O-N 3.01Å; L67-I69 WeakPolarHBondContact CD1-O 3.39Å; I69-V72 VanDerWaalsContact CG2-O 3.31Å; I69-V72 WeakPolarHBondContact CG2-O 3.46Å; I69-T74 CarbonylContact C-O 3.52Å; I69-T74 VanDerWaalsContact CA-O 3.31Å; I69-T74 WeakPolarHBondContact CA-O 3.31Å; I69-R75 HydrophobicContact CD1-CB 3.95Å; I69-R75 HydrophobicContact CD1-CG 4.38Å; I69-L94 HydrophobicContact CG1-CD1 3.87Å
70	Y	96.9	Very high	93.5	Very high	83 Å²	83	73.1 Å²	73.1	33%	0.325	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-126.8	163	168.7	68.3	-82.3	0	0	0	109.9	L67 V72 T74 P76	L67-Y70 HydrophobicContact CD2-CD1 4.47Å; Y70-V72 VanDerWaalsContact C-N 3.26Å; Y70-V72 PolarHBondContact O-N 3.38Å; Y70-T74 HydrophobicContact CD1-CG2 4.33Å; Y70-T74 WeakPolarHBondContact CD1-O 3.2Å; Y70-T74 HydrophobicContact CE1-CG2 3.55Å; Y70-T74 HydrophobicContact CE2-CG2 3.76Å; Y70-T74 PolarHBondContact N-O 3.44Å; Y70-T74 WeakPolarHBondContact O-CA 3.45Å; Y70-T74 VanDerWaalsContact O-CB 3.29Å; Y70-T74 WeakPolarHBondContact O-CB 3.14Å; Y70-T74 PolarHBondContact O-N 2.9Å; Y70-T74 WeakPolarHBondContact OH-CG2 3.3Å; Y70-P76 HydrophobicContact CD1-CG 3.79Å; Y70-P76 HydrophobicContact CE1-CG 3.99Å
71	N	96.4	Very high	93.8	Very high	62 Å²	62	74.1 Å²	74.1	33%	0.332	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	50.5	-176.7	-66.1	-14.7	0	0	0	112.8	D52 H53 V54 N73	D52-N71 CarbonylContact O-C 3.58Å; D52-N71 WeakPolarHBondContact O-CA 3.36Å; H53-N71 PolarHBondContact ND1-OD1 2.88Å; V54-N71 PolarHBondContact O-N 2.96Å; N71-N73 PolarHBondContact O-N 3.46Å; N71-N73 PolarHBondContact O-OD1 2.87Å
72	V	97.1	Very high	94.4	Very high	11 Å²	11	68.3 Å²	68.3	7%	0.067	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	-47	178.4	176.2	0	0	0	0	115.6	D52 V54 I69 Y70 G85 S86 K87	D52-V72 HydrophobicContact CB-CG2 4.06Å; V54-V72 HydrophobicContact CB-CG2 4.14Å; V54-V72 HydrophobicContact CG2-CG2 4.16Å; V54-V72 PolarHBondContact O-N 2.84Å; I69-V72 VanDerWaalsContact CG2-O 3.31Å; I69-V72 WeakPolarHBondContact CG2-O 3.46Å; Y70-V72 VanDerWaalsContact C-N 3.26Å; Y70-V72 PolarHBondContact O-N 3.38Å; V72-G85 CarbonylContact O-C 3.58Å; V72-G85 WeakPolarHBondContact O-CA 3.27Å; V72-S86 PolarHBondContact O-N 3.01Å; V72-K87 HydrophobicContact CG1-CB 3.5Å; V72-K87 HydrophobicContact CG2-CB 4.28Å; V72-K87 HydrophobicContact CG2-CD 4.39Å
73	N	97.9	Very high	95.4	Very high	108 Å²	108	62.3 Å²	62.3	58%	0.578	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.8	-1.3	-168.5	65.4	7.4	0	0	0	114.3	N71 G85	N71-N73 PolarHBondContact O-N 3.46Å; N71-N73 PolarHBondContact O-OD1 2.87Å; N73-G85 VanDerWaalsContact CB-O 3.31Å; N73-G85 WeakPolarHBondContact CB-O 3.37Å
74	T	98.2	Very high	96.4	Very high	48 Å²	48	61.7 Å²	61.7	29%	0.294	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-90.6	124.8	-175.2	-50.7	0	0	0	0	110.6	I69 Y70	I69-T74 CarbonylContact C-O 3.52Å; I69-T74 VanDerWaalsContact CA-O 3.31Å; I69-T74 WeakPolarHBondContact CA-O 3.31Å; Y70-T74 HydrophobicContact CD1-CG2 4.33Å; Y70-T74 WeakPolarHBondContact CD1-O 3.2Å; Y70-T74 HydrophobicContact CE1-CG2 3.55Å; Y70-T74 HydrophobicContact CE2-CG2 3.76Å; Y70-T74 PolarHBondContact N-O 3.44Å; Y70-T74 WeakPolarHBondContact O-CA 3.45Å; Y70-T74 VanDerWaalsContact O-CB 3.29Å; Y70-T74 WeakPolarHBondContact O-CB 3.14Å; Y70-T74 PolarHBondContact O-N 2.9Å; Y70-T74 WeakPolarHBondContact OH-CG2 3.3Å
75	R	98.2	Very high	96.9	Very high	101 Å²	101	56 Å²	56	38%	0.381	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-97.8	125.7	-179.3	-178.7	168.7	55.3	-141.2	3.9	110.4	I69 I79 S80 D81 F83	I69-R75 HydrophobicContact CD1-CB 3.95Å; I69-R75 HydrophobicContact CD1-CG 4.38Å; R75-I79 HydrophobicContact CG-CB 3.55Å; R75-I79 HydrophobicContact CG-CG1 4.4Å; R75-I79 HydrophobicContact CG-CG2 3.71Å; R75-S80 WeakPolarHBondContact CD-O 3.28Å; R75-D81 PolarHBondContact NH1-O 2.68Å; R75-D81 VanDerWaalsContact NH1-O 3.15Å; R75-F83 PolarHBondContact NH1-O 3.25Å
76	P	97.8	Very high	97.3	Very high	31 Å²	31	55.7 Å²	55.7	20%	0.201	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-59.9	154.7	172.2	-21.1	31.4	0	0	0	112.9	L67 L68 Y70 I79	L67-P76 HydrophobicContact CD2-CG 3.92Å; L67-P76 HydrophobicContact CG-CG 4.02Å; L68-P76 WeakPolarHBondContact O-CD 3.34Å; Y70-P76 HydrophobicContact CD1-CG 3.79Å; Y70-P76 HydrophobicContact CE1-CG 3.99Å; P76-I79 HydrophobicContact CB-CG1 4Å; P76-I79 HydrophobicContact CG-CG1 4.21Å; P76-I79 WeakPolarHBondContact O-CB 3.31Å; P76-I79 WeakPolarHBondContact O-CG1 3.34Å; P76-I79 PolarHBondContact O-N 2.86Å
77	S	97.1	Very high	97.4	Very high	130 Å²	130	52.8 Å²	52.8	91%	0.909	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	138.5	173.1	-65.3	0	0	0	0	111.5	I79	S77-I79 VanDerWaalsContact C-N 3.3Å; S77-I79 PolarHBondContact O-N 2.02Å
78	G	96	Very high	97.4	Very high	68 Å²	68	55 Å²	55	70%	0.701	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	3.2	-179.7	0	0	0	0	0	115.3	R66	R66-G78 PolarHBondContact NH2-O 2.99Å
79	I	96.9	Very high	97.3	Very high	19 Å²	19	57.5 Å²	57.5	10%	0.097	36%	0.357	C	S	.	.			trans	-88.4	137.3	167.2	-55.4	-63	0	0	0	109.3	R66 L67 L68 R75 P76 S77 F83	R66-I79 HydrophobicContact CG-CD1 4.19Å; L67-I79 WeakPolarHBondContact O-CD1 3.2Å; L68-I79 HydrophobicContact CD2-CD1 4.42Å; L68-I79 HydrophobicContact CD2-CG2 4.27Å; R75-I79 HydrophobicContact CG-CB 3.55Å; R75-I79 HydrophobicContact CG-CG1 4.4Å; R75-I79 HydrophobicContact CG-CG2 3.71Å; P76-I79 HydrophobicContact CB-CG1 4Å; P76-I79 HydrophobicContact CG-CG1 4.21Å; P76-I79 WeakPolarHBondContact O-CB 3.31Å; P76-I79 WeakPolarHBondContact O-CG1 3.34Å; P76-I79 PolarHBondContact O-N 2.86Å; S77-I79 VanDerWaalsContact C-N 3.3Å; S77-I79 PolarHBondContact O-N 2.02Å; I79-F83 HydrophobicContact CG2-CB 4.48Å; I79-F83 HydrophobicContact CG2-CD2 3.87Å
80	S	96.3	Very high	97.2	Very high	48 Å²	48	60.8 Å²	60.8	34%	0.336	38%	0.375	S	S	.	.			trans	-61.6	148.8	-178.3	171.3	0	0	0	0	112.3	R75 L82 F83	R75-S80 WeakPolarHBondContact CD-O 3.28Å; S80-L82 PolarHBondContact O-N 2.84Å; S80-L82 VanDerWaalsContact OG-CG 3.27Å; S80-L82 WeakPolarHBondContact OG-CG 3.31Å; S80-L82 PolarHBondContact OG-N 3.19Å; S80-F83 PolarHBondContact O-N 3.35Å
81	D	96.3	Very high	97.2	Very high	120 Å²	120	60.7 Å²	60.7	64%	0.642	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.5	176.6	63.8	-24.4	0	0	0	114.9	R75 F83	R75-D81 PolarHBondContact NH1-O 2.68Å; R75-D81 VanDerWaalsContact NH1-O 3.15Å; D81-F83 PolarHBondContact O-N 2.85Å
82	L	97.1	Very high	97.3	Very high	34 Å²	34	57.7 Å²	57.7	18%	0.178	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24	176.3	-58.7	176	0	0	0	113.5	S80 I96 S97	S80-L82 PolarHBondContact O-N 2.84Å; S80-L82 VanDerWaalsContact OG-CG 3.27Å; S80-L82 WeakPolarHBondContact OG-CG 3.31Å; S80-L82 PolarHBondContact OG-N 3.19Å; L82-I96 WeakPolarHBondContact O-CA 3.35Å; L82-S97 WeakPolarHBondContact CA-OG 3.32Å; L82-S97 WeakPolarHBondContact CD2-O 3.19Å; L82-S97 PolarHBondContact O-N 3.27Å; L82-S97 PolarHBondContact O-OG 3.13Å
83	F	98.2	Very high	97.3	Very high	10 Å²	10	58.1 Å²	58.1	4%	0.044	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.6	-179.5	-57.3	-77.2	0	0	0	110.9	L68 R75 I79 S80 D81 L94 I96 V103 Y107	L68-F83 HydrophobicContact CD1-CD1 3.84Å; L68-F83 HydrophobicContact CD1-CE1 3.96Å; L68-F83 HydrophobicContact CD1-CG 4.37Å; L68-F83 HydrophobicContact CD2-CD2 4.39Å; L68-F83 HydrophobicContact CD2-CE2 4.34Å; L68-F83 HydrophobicContact CD2-CZ 4.44Å; R75-F83 PolarHBondContact NH1-O 3.25Å; I79-F83 HydrophobicContact CG2-CB 4.48Å; I79-F83 HydrophobicContact CG2-CD2 3.87Å; S80-F83 PolarHBondContact O-N 3.35Å; D81-F83 PolarHBondContact O-N 2.85Å; F83-L94 HydrophobicContact CB-CD1 4.39Å; F83-L94 HydrophobicContact CD1-CD1 4.46Å; F83-I96 HydrophobicContact CD1-CG1 3.98Å; F83-I96 HydrophobicContact CD1-CG2 4.33Å; F83-I96 HydrophobicContact CE1-CD1 4.17Å; F83-I96 HydrophobicContact CE1-CG1 4.07Å; F83-I96 HydrophobicContact CE1-CG2 4.02Å; F83-V103 HydrophobicContact CE1-CG1 4.49Å; F83-V103 HydrophobicContact CZ-CG1 3.88Å; F83-Y107 AromaticContact CE1-CE1 3.95Å; F83-Y107 HydrophobicContact CE1-CE1 3.95Å
84	S	98.4	Very high	97.4	Very high	56 Å²	56	53 Å²	53	39%	0.392	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.1	170.9	61.2	0	0	0	0	111	L94 T95	S84-L94 CarbonylContact O-C 3.59Å; S84-L94 WeakPolarHBondContact O-CA 3.27Å; S84-T95 PolarHBondContact N-O 3.28Å; S84-T95 PolarHBondContact O-N 2.81Å
85	G	98.4	Very high	97.4	Very high	12 Å²	12	52.3 Å²	52.3	12%	0.124	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.6	177.8	0	0	0	0	0	112.1	V72 N73 S93	V72-G85 CarbonylContact O-C 3.58Å; V72-G85 WeakPolarHBondContact O-CA 3.27Å; N73-G85 VanDerWaalsContact CB-O 3.31Å; N73-G85 WeakPolarHBondContact CB-O 3.37Å; G85-S93 CarbonylContact C-O 3.5Å; G85-S93 VanDerWaalsContact CA-O 3.28Å; G85-S93 WeakPolarHBondContact CA-O 2.97Å
86	S	98.3	Very high	97.4	Very high	59 Å²	59	47.7 Å²	47.7	41%	0.413	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	168.2	175.2	65.7	0	0	0	0	111.2	V72 A92 S93	V72-S86 PolarHBondContact O-N 3.01Å; S86-A92 CarbonylContact O-C 3.46Å; S86-A92 WeakPolarHBondContact O-CA 3.36Å; S86-S93 PolarHBondContact N-O 2.94Å; S86-S93 PolarHBondContact O-N 3.36Å
87	K	97.1	Very high	97.4	Very high	55 Å²	55	48.2 Å²	48.2	24%	0.239	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143.2	173.6	-176.1	-178.4	68.7	166.8	0	110.3	V48 G49 Y51 D52 V72 G89 M91	V48-K87 HydrophobicContact CG1-CD 3.88Å; V48-K87 HydrophobicContact CG1-CG 4.26Å; V48-K87 WeakPolarHBondContact O-CD 3.2Å; V48-K87 PolarHBondContact O-NZ 3.28Å; G49-K87 PolarHBondContact O-NZ 2.97Å; Y51-K87 PolarHBondContact O-NZ 2.86Å; D52-K87 WeakPolarHBondContact OD1-CE 3.07Å; D52-K87 IonicContact OD1-NZ 2.68Å; D52-K87 PolarHBondContact OD1-NZ 3.3Å; V72-K87 HydrophobicContact CG1-CB 3.5Å; V72-K87 HydrophobicContact CG2-CB 4.28Å; V72-K87 HydrophobicContact CG2-CD 4.39Å; K87-G89 WeakPolarHBondContact CD-O 3Å; K87-G89 WeakPolarHBondContact CG-O 3.48Å; K87-M91 CarbonylContact C-O 3.15Å; K87-M91 WeakPolarHBondContact CA-O 3.12Å
88	S	97.1	Very high	97.4	Very high	99 Å²	99	43 Å²	43	69%	0.692	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	119.1	166.5	-178.4	0	0	0	0	109.1	N90 M91	S88-N90 PolarHBondContact O-N 2.85Å; S88-M91 PolarHBondContact N-O 3.32Å; S88-M91 PolarHBondContact O-N 3.47Å
89	G	95.8	Very high	97.4	Very high	53 Å²	53	40.9 Å²	40.9	55%	0.546	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	-128.4	-172.9	0	0	0	0	0	111.5	G49 K87 M91	G49-G89 WeakPolarHBondContact CA-O 3.23Å; K87-G89 WeakPolarHBondContact CD-O 3Å; K87-G89 WeakPolarHBondContact CG-O 3.48Å; G89-M91 VanDerWaalsContact C-N 3.29Å; G89-M91 PolarHBondContact O-N 3.03Å
90	N	95.3	Very high	97.3	Very high	70 Å²	70	46.2 Å²	46.2	37%	0.374	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	14.6	177.8	65.1	-30.5	0	0	0	114.3	G43 T44 V48 S88	G43-N90 PolarHBondContact N-O 3.12Å; G43-N90 PolarHBondContact O-ND2 2.88Å; T44-N90 WeakPolarHBondContact O-CB 3.19Å; V48-N90 VanDerWaalsContact CG1-C 3.42Å; V48-N90 WeakPolarHBondContact CG1-O 3.41Å; S88-N90 PolarHBondContact O-N 2.85Å
91	M	97.3	Very high	97	Very high	80 Å²	80	48.8 Å²	48.8	39%	0.394	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	115.6	-179.9	-172.2	-179.1	-63.8	0	0	110.8	K87 S88 G89	K87-M91 CarbonylContact C-O 3.15Å; K87-M91 WeakPolarHBondContact CA-O 3.12Å; S88-M91 PolarHBondContact N-O 3.32Å; S88-M91 PolarHBondContact O-N 3.47Å; G89-M91 VanDerWaalsContact C-N 3.29Å; G89-M91 PolarHBondContact O-N 3.03Å
92	A	97.9	Very high	96.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	157.2	167.2	0	0	0	0	0	110.8	S40 C41 V48 V54 S86	S40-A92 WeakPolarHBondContact CA-O 3.49Å; C41-A92 HydrophobicContact CB-CB 4.33Å; C41-A92 PolarHBondContact N-O 2.91Å; C41-A92 PolarHBondContact O-N 2.92Å; V48-A92 HydrophobicContact CG1-CB 4.22Å; V54-A92 HydrophobicContact CB-CB 4.2Å; V54-A92 HydrophobicContact CG1-CB 3.71Å; V54-A92 HydrophobicContact CG2-CB 3.96Å; S86-A92 CarbonylContact O-C 3.46Å; S86-A92 WeakPolarHBondContact O-CA 3.36Å
93	S	98.4	Very high	96.6	Very high	20 Å²	20	48.8 Å²	48.8	14%	0.14	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	140.1	-178.5	-70.7	0	0	0	0	110.7	I39 G85 S86	I39-S93 CarbonylContact O-C 3.58Å; I39-S93 WeakPolarHBondContact O-CA 3.49Å; G85-S93 CarbonylContact C-O 3.5Å; G85-S93 VanDerWaalsContact CA-O 3.28Å; G85-S93 WeakPolarHBondContact CA-O 2.97Å; S86-S93 PolarHBondContact N-O 2.94Å; S86-S93 PolarHBondContact O-N 3.36Å
94	L	98.7	Very high	96.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116	165.2	175.6	71.1	0	0	0	108.1	T38 I39 W56 L68 I69 F83 S84 I96 Y107	T38-L94 CarbonylContact C-O 3.53Å; T38-L94 WeakPolarHBondContact CA-O 3.27Å; I39-L94 HydrophobicContact CD1-CD2 4.45Å; I39-L94 PolarHBondContact N-O 3.31Å; I39-L94 PolarHBondContact O-N 3.05Å; W56-L94 HydrophobicContact CB-CD1 4.3Å; W56-L94 HydrophobicContact CB-CD2 4.33Å; W56-L94 HydrophobicContact CD2-CB 3.48Å; W56-L94 VanDerWaalsContact CD2-CB 3.48Å; W56-L94 HydrophobicContact CD2-CD2 4.08Å; W56-L94 HydrophobicContact CD2-CG 4.24Å; W56-L94 HydrophobicContact CE3-CB 3.69Å; W56-L94 HydrophobicContact CE3-CD2 3.78Å; W56-L94 HydrophobicContact CE3-CG 4.34Å; W56-L94 HydrophobicContact CG-CB 3.98Å; W56-L94 HydrophobicContact CG-CD1 4.19Å; W56-L94 HydrophobicContact CG-CD2 4.32Å; W56-L94 HydrophobicContact CG-CG 4.41Å; W56-L94 HydrophobicContact CH2-CB 3.95Å; W56-L94 HydrophobicContact CZ2-CB 3.76Å; W56-L94 HydrophobicContact CZ3-CB 3.92Å; W56-L94 HydrophobicContact CZ3-CD2 4.38Å; L68-L94 HydrophobicContact CD1-CD2 4.01Å; I69-L94 HydrophobicContact CG1-CD1 3.87Å; F83-L94 HydrophobicContact CB-CD1 4.39Å; F83-L94 HydrophobicContact CD1-CD1 4.46Å; S84-L94 CarbonylContact O-C 3.59Å; S84-L94 WeakPolarHBondContact O-CA 3.27Å; L94-I96 HydrophobicContact CD2-CD1 4.43Å; L94-I96 HydrophobicContact CD2-CG1 4.38Å; L94-I96 HydrophobicContact CG-CG1 4.27Å; L94-Y107 HydrophobicContact CD2-CD1 3.66Å; L94-Y107 HydrophobicContact CD2-CE1 4.21Å; L94-Y107 HydrophobicContact CD2-CG 4.32Å
95	T	98.6	Very high	96.3	Very high	34 Å²	34	54.8 Å²	54.8	21%	0.209	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.2	171.5	-62.5	0	0	0	0	109.3	V37 T38 S84	V37-T95 WeakPolarHBondContact O-CA 3.44Å; T38-T95 PolarHBondContact OG1-OG1 3.47Å; T38-T95 VanDerWaalsContact OG1-OG1 3.06Å; S84-T95 PolarHBondContact N-O 3.28Å; S84-T95 PolarHBondContact O-N 2.81Å
96	I	98.4	Very high	96.2	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.015	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	109.4	174.2	-49.9	176	0	0	0	106.3	S36 V37 I39 L82 F83 L94 L99 V103 Y107	S36-I96 CarbonylContact C-O 3.58Å; S36-I96 VanDerWaalsContact CA-O 3.23Å; S36-I96 WeakPolarHBondContact CA-O 3.35Å; V37-I96 HydrophobicContact CG2-CB 4.07Å; V37-I96 PolarHBondContact N-O 2.98Å; V37-I96 PolarHBondContact O-N 3.27Å; I39-I96 HydrophobicContact CD1-CD1 4.14Å; L82-I96 WeakPolarHBondContact O-CA 3.35Å; F83-I96 HydrophobicContact CD1-CG1 3.98Å; F83-I96 HydrophobicContact CD1-CG2 4.33Å; F83-I96 HydrophobicContact CE1-CD1 4.17Å; F83-I96 HydrophobicContact CE1-CG1 4.07Å; F83-I96 HydrophobicContact CE1-CG2 4.02Å; L94-I96 HydrophobicContact CD2-CD1 4.43Å; L94-I96 HydrophobicContact CD2-CG1 4.38Å; L94-I96 HydrophobicContact CG-CG1 4.27Å; I96-L99 HydrophobicContact CG2-CD2 4.08Å; I96-V103 HydrophobicContact CG2-CB 4.22Å; I96-V103 HydrophobicContact CG2-CG1 4.41Å; I96-V103 HydrophobicContact CG2-CG2 4.06Å; I96-Y107 HydrophobicContact CD1-CD1 4.39Å; I96-Y107 HydrophobicContact CD1-CD2 4.36Å; I96-Y107 HydrophobicContact CD1-CE1 3.83Å; I96-Y107 HydrophobicContact CD1-CE2 3.81Å
97	S	97.9	Very high	96.1	Very high	42 Å²	42	58.1 Å²	58.1	29%	0.294	33%	0.332	S	S	.	.			trans	-89.5	157.7	177.5	66.5	0	0	0	0	111.5	S36 L82 L99	S36-S97 WeakPolarHBondContact OG-CA 3.48Å; L82-S97 WeakPolarHBondContact CA-OG 3.32Å; L82-S97 WeakPolarHBondContact CD2-O 3.19Å; L82-S97 PolarHBondContact O-N 3.27Å; L82-S97 PolarHBondContact O-OG 3.13Å; S97-L99 PolarHBondContact O-N 3.03Å
98	G	96.4	Very high	96	Very high	21 Å²	21	60.7 Å²	60.7	22%	0.216	35%	0.345	C	S	.	.	S	Bend	trans	56.9	54.1	171.9	0	0	0	0	0	113.5	Q35 K100	Q35-G98 PolarHBondContact O-N 2.5Å; Q35-G98 VanDerWaalsContact O-N 3.14Å; G98-K100 WeakPolarHBondContact O-CG 3.39Å; G98-K100 PolarHBondContact O-N 2.6Å
99	L	96.7	Very high	96	Very high	24 Å²	24	56 Å²	56	13%	0.126	31%	0.312	C	S	.	.			trans	-49.1	133.2	-177.2	-78.3	-177.4	0	0	0	113.1	P33 G34 Q35 V37 I96 S97 V103	P33-L99 WeakPolarHBondContact CA-O 3.26Å; G34-L99 PolarHBondContact N-O 2.83Å; Q35-L99 WeakPolarHBondContact O-CG 3.48Å; Q35-L99 PolarHBondContact O-N 2.96Å; V37-L99 HydrophobicContact CG1-CD1 3.66Å; V37-L99 HydrophobicContact CG2-CD1 4.15Å; V37-L99 HydrophobicContact CG2-CD2 3.86Å; V37-L99 HydrophobicContact CG2-CG 4.28Å; I96-L99 HydrophobicContact CG2-CD2 4.08Å; S97-L99 PolarHBondContact O-N 3.03Å; L99-V103 HydrophobicContact CD2-CG2 3.68Å
100	K	94.3	Very high	95.9	Very high	130 Å²	130	54.9 Å²	54.9	57%	0.565	30%	0.295	S	S	*	.			trans	-142.5	162.4	177.4	-65.7	172.5	-168.8	178.2	0	108.8	G98 E102 V103	G98-K100 WeakPolarHBondContact O-CG 3.39Å; G98-K100 PolarHBondContact O-N 2.6Å; K100-E102 PolarHBondContact O-N 2.98Å; K100-E102 VanDerWaalsContact O-N 3.1Å; K100-V103 WeakPolarHBondContact O-CG2 3.49Å; K100-V103 PolarHBondContact O-N 3.4Å; K100-V103 VanDerWaalsContact O-N 3.1Å
101	S	90.7	Very high	95.6	Very high	103 Å²	103	53.5 Å²	53.5	72%	0.72	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-55.7	-30.5	178.2	51.6	0	0	0	0	113.3	V103 E104	S101-V103 VanDerWaalsContact C-N 3.26Å; S101-V103 PolarHBondContact O-N 3.14Å; S101-E104 WeakPolarHBondContact O-CB 3.17Å; S101-E104 PolarHBondContact O-N 3.04Å
102	E	91.3	Very high	94.7	Very high	140 Å²	140	57.1 Å²	57.1	65%	0.654	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-64.1	-26.4	179.9	-63.8	173.7	-158.6	0	0	113.8	R60 K100 E104	R60-E102 PolarHBondContact NE-O 3.32Å; R60-E102 PolarHBondContact NH2-O 2.75Å; K100-E102 PolarHBondContact O-N 2.98Å; K100-E102 VanDerWaalsContact O-N 3.1Å; E102-E104 VanDerWaalsContact C-N 3.34Å
103	V	93.6	Very high	93.1	Very high	13 Å²	13	61.5 Å²	61.5	8%	0.079	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-92.6	6.8	-178.7	-60	0	0	0	0	112.9	F83 I96 L99 K100 S101 A105 Y107	F83-V103 HydrophobicContact CE1-CG1 4.49Å; F83-V103 HydrophobicContact CZ-CG1 3.88Å; I96-V103 HydrophobicContact CG2-CB 4.22Å; I96-V103 HydrophobicContact CG2-CG1 4.41Å; I96-V103 HydrophobicContact CG2-CG2 4.06Å; L99-V103 HydrophobicContact CD2-CG2 3.68Å; K100-V103 WeakPolarHBondContact O-CG2 3.49Å; K100-V103 PolarHBondContact O-N 3.4Å; K100-V103 VanDerWaalsContact O-N 3.1Å; S101-V103 VanDerWaalsContact C-N 3.26Å; S101-V103 PolarHBondContact O-N 3.14Å; V103-A105 PolarHBondContact O-N 2.97Å; V103-Y107 PolarHBondContact O-OH 2.94Å
104	E	94.6	Very high	90.8	Very high	164 Å²	164	62.3 Å²	62.3	77%	0.766	34%	0.335	S	S	*	.			trans	-70.9	113.2	170.2	-167.6	177.8	154.6	0	0	110.1	S101 E102	S101-E104 WeakPolarHBondContact O-CB 3.17Å; S101-E104 PolarHBondContact O-N 3.04Å; E102-E104 VanDerWaalsContact C-N 3.34Å
105	A	95.2	Very high	88.5	Confident	28 Å²	28	66.6 Å²	66.6	23%	0.231	36%	0.364	C	S	.	.	S	Bend	trans	-165.8	172.7	-175.3	0	0	0	0	0	111.6	Q58 R60 V103 Y107	Q58-A105 HydrophobicContact CG-CB 3.49Å; Q58-A105 VanDerWaalsContact CG-CB 3.49Å; R60-A105 HydrophobicContact CG-CB 3.95Å; V103-A105 PolarHBondContact O-N 2.97Å; A105-Y107 HydrophobicContact CB-CE2 3.93Å; A105-Y107 VanDerWaalsContact O-CD2 3.31Å; A105-Y107 WeakPolarHBondContact O-CD2 3.3Å; A105-Y107 WeakPolarHBondContact O-CE2 3.31Å
106	N	96.1	Very high	85.9	Confident	108 Å²	108	74 Å²	74	58%	0.578	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.4	165.8	-64.5	-59.4	0	0	0	109.9	Q58 K59	Q58-N106 CarbonylContact C-O 3.6Å; K59-N106 HydrophobicContact CB-CB 4.43Å; K59-N106 PolarHBondContact N-O 3.46Å; K59-N106 PolarHBondContact O-N 2.77Å
107	Y	97	Very high	82.9	Confident	33 Å²	33	79.2 Å²	79.2	13%	0.129	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.7	179.7	-64.9	-87.7	0	0	0	110.5	Q25 I39 Y57 Q58 L68 F83 L94 I96 V103 A105	Q25-Y107 PolarHBondContact NE2-O 2.84Å; I39-Y107 HydrophobicContact CD1-CD1 4.46Å; I39-Y107 HydrophobicContact CD1-CD2 3.65Å; I39-Y107 HydrophobicContact CD1-CE2 4.45Å; I39-Y107 HydrophobicContact CD1-CG 3.65Å; Y57-Y107 WeakPolarHBondContact O-CA 3.35Å; Q58-Y107 HydrophobicContact CB-CD1 4.34Å; Q58-Y107 HydrophobicContact CB-CE1 4.07Å; Q58-Y107 HydrophobicContact CG-CD1 4.37Å; Q58-Y107 HydrophobicContact CG-CE1 3.8Å; Q58-Y107 PolarHBondContact NE2-OH 3.32Å; L68-Y107 HydrophobicContact CD1-CD1 3.75Å; L68-Y107 HydrophobicContact CD1-CE1 3.59Å; F83-Y107 AromaticContact CE1-CE1 3.95Å; F83-Y107 HydrophobicContact CE1-CE1 3.95Å; L94-Y107 HydrophobicContact CD2-CD1 3.66Å; L94-Y107 HydrophobicContact CD2-CE1 4.21Å; L94-Y107 HydrophobicContact CD2-CG 4.32Å; I96-Y107 HydrophobicContact CD1-CD1 4.39Å; I96-Y107 HydrophobicContact CD1-CD2 4.36Å; I96-Y107 HydrophobicContact CD1-CE1 3.83Å; I96-Y107 HydrophobicContact CD1-CE2 3.81Å; V103-Y107 PolarHBondContact O-OH 2.94Å; A105-Y107 HydrophobicContact CB-CE2 3.93Å; A105-Y107 VanDerWaalsContact O-CD2 3.31Å; A105-Y107 WeakPolarHBondContact O-CD2 3.3Å; A105-Y107 WeakPolarHBondContact O-CE2 3.31Å
108	H	95.4	Very high	80	Confident	110 Å²	110	90 Å²	90	51%	0.509	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.2	-178.2	176.3	-95.5	0	0	0	110.7	Y57	Y57-H108 PolarHBondContact N-O 2.83Å; Y57-H108 PolarHBondContact O-N 3.32Å
109	C	96.2	Very high	79.2	Confident	0 Å²	0	93.5 Å²	93.5	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	146	170.9	65.8	0	0	0	0	110.9	Q25 C41 V54 F55 W56	Q25-C109 PolarHBondContact OE1-SG 2.77Å; C41-C109 HydrophobicContact CB-CB 3.49Å; C41-C109 VanDerWaalsContact CB-CB 3.49Å; C41-C109 WeakPolarHBondContact CB-SG 3.21Å; C41-C109 WeakPolarHBondContact SG-CB 3.34Å; C41-C109 CovalentContact SG-SG 2.02Å; C41-C109 PolarHBondContact SG-SG 2.93Å; V54-C109 HydrophobicContact CG1-CB 4.48Å; F55-C109 CarbonylContact O-C 3.53Å; F55-C109 WeakPolarHBondContact O-CA 3.29Å; W56-C109 HydrophobicContact CD2-CB 4.14Å; W56-C109 HydrophobicContact CE3-CB 4.01Å; W56-C109 HydrophobicContact CH2-CB 4.04Å; W56-C109 HydrophobicContact CZ2-CB 4.16Å; W56-C109 HydrophobicContact CZ3-CB 3.96Å
110	S	93.8	Very high	78.3	Confident	29 Å²	29	97.2 Å²	97.2	20%	0.203	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	163.4	169.8	78.5	0	0	0	0	111.2	V54 F55 Y57	V54-S110 WeakPolarHBondContact CA-O 3.45Å; F55-S110 PolarHBondContact N-O 2.96Å; F55-S110 PolarHBondContact O-N 2.83Å; Y57-S110 WeakPolarHBondContact CE2-OG 3.14Å
111	L	90.3	Very high	77.4	Confident	42 Å²	42	95.3 Å²	95.3	22%	0.22	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	149.7	171.5	-65.8	177.1	0	0	0	110.7	L23 D47 V48 H53 V54 S113	L23-L111 HydrophobicContact CD1-CG 4.09Å; L23-L111 HydrophobicContact CD2-CD1 3.88Å; L23-L111 HydrophobicContact CD2-CG 4.14Å; D47-L111 HydrophobicContact CB-CD1 3.48Å; D47-L111 VanDerWaalsContact CB-CD1 3.48Å; V48-L111 HydrophobicContact CG2-CD1 4.14Å; V48-L111 HydrophobicContact CG2-CD2 4.02Å; V48-L111 HydrophobicContact CG2-CG 4.48Å; H53-L111 WeakPolarHBondContact O-CA 3.21Å; V54-L111 HydrophobicContact CB-CD2 4.38Å; V54-L111 HydrophobicContact CG2-CD2 3.64Å; L111-S113 PolarHBondContact O-N 3.49Å
112	Y	77.6	Confident	76.6	Confident	155 Å²	155	94.9 Å²	94.9	61%	0.608	48%	0.478	S	S	*	.			trans	-75.4	104.1	158.7	-173.6	-102.6	0	0	0	108	H53 S114	H53-Y112 PolarHBondContact O-N 2.95Å; H53-Y112 VanDerWaalsContact O-N 3.13Å; Y112-S114 PolarHBondContact O-N 3Å
113	S	63.8	Low	75.7	Confident	92 Å²	92	92.1 Å²	92.1	64%	0.643	47%	0.467	S	S	*	.			trans	-78.4	97.6	168.5	-174.1	0	0	0	0	107.8	L111 S115	L111-S113 PolarHBondContact O-N 3.49Å; S113-S115 VanDerWaalsContact C-N 3.25Å; S113-S115 PolarHBondContact O-N 3.38Å
114	S	51.4	Low	74.5	Confident	37 Å²	37	97.3 Å²	97.3	26%	0.259	49%	0.493	S	S	.	.			trans	-71.7	93.3	158.4	57.9	0	0	0	0	106.2	Y112 Y116	Y112-S114 PolarHBondContact O-N 3Å; S114-Y116 PolarHBondContact O-N 3.18Å; S114-Y116 VanDerWaalsContact OG-CD2 3.31Å; S114-Y116 WeakPolarHBondContact OG-CD2 3.22Å; S114-Y116 VanDerWaalsContact OG-CE2 3.3Å; S114-Y116 WeakPolarHBondContact OG-CE2 3.44Å
115	S	49	Very low	73	Confident	90 Å²	90	92.6 Å²	92.6	63%	0.629	47%	0.473	S	S	*	.			trans	-64.9	80.5	164.4	56.3	0	0	0	0	107.9	S113 T117	S113-S115 VanDerWaalsContact C-N 3.25Å; S113-S115 PolarHBondContact O-N 3.38Å; S115-T117 PolarHBondContact O-N 3.36Å
116	Y	43.5	Very low	71.3	Confident	191 Å²	191	97.5 Å²	97.5	75%	0.749	49%	0.492	S	S	*	.			trans	-75.5	78.4	161	-72.1	-72.3	0	0	0	106.4	S114 F118	S114-Y116 PolarHBondContact O-N 3.18Å; S114-Y116 VanDerWaalsContact OG-CD2 3.31Å; S114-Y116 WeakPolarHBondContact OG-CD2 3.22Å; S114-Y116 VanDerWaalsContact OG-CE2 3.3Å; S114-Y116 WeakPolarHBondContact OG-CE2 3.44Å; Y116-F118 PolarHBondContact O-N 3.01Å
117	T	37.1	Very low	69.3	Low	111 Å²	111	96.7 Å²	96.7	68%	0.681	49%	0.485	S	S	*	.			trans	-69.6	109.8	164.9	42	0	0	0	0	108	S115	S115-T117 PolarHBondContact O-N 3.36Å
118	F	36.2	Very low	66.8	Low	270 Å²	270	102.5 Å²	102.5	100%	1.184	52%	0.517	S	S	*	.			trans	-100.1	0	146.1	-74.1	-78.5	0	0	0	108.1	Y116	Y116-F118 PolarHBondContact O-N 3.01Å

Retrieved 118 of 118 residues in 95.4 ms (Link to these results)

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