A0A087XK14_POEFO Loading...

Polymerase (DNA directed) iota

AlphaFold DB , UniProt , Accession A0A087XK14, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 672 aa.

Structure Viewer

Loading PAE data...

(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	33.7	Very low	33.4	Very low	242 Å²	242	139.8 Å²	139.8	100%	1.192	77%	0.765	S	S	*	*				0	101.4	0	-63.9	173.7	175.3	0	0	104.2
2	D	26.1	Very low	34.5	Very low	164 Å²	164	137.1 Å²	137.1	88%	0.877	74%	0.743	S	S	*	*			cis	-129.1	138.6	31.9	-109.1	-29	0	0	0	112.5
3	N	30.6	Very low	34.3	Very low	130 Å²	130	134 Å²	134	70%	0.695	73%	0.732	S	S	*	*			trans	-91.9	110.8	171.5	-81	-9.1	0	0	0	108.3
4	S	26.9	Very low	34.8	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	72%	0.717	S	S	*	*			trans	-106.7	73.1	159.6	67.3	0	0	0	0	108.7	G6	S4-G6 PolarHBondContact O-N 3.46Å
5	D	34.9	Very low	35.3	Very low	127 Å²	127	134.1 Å²	134.1	68%	0.679	71%	0.709	S	S	*	*			trans	-81.6	94.6	166.4	-78.7	-39.1	0	0	0	108.5
6	G	31.1	Very low	35.1	Very low	68 Å²	68	134.9 Å²	134.9	70%	0.701	70%	0.704	S	S	*	*			trans	-104	125.9	160.8	0	0	0	0	0	108.4	S4	S4-G6 PolarHBondContact O-N 3.46Å
7	E	35.9	Very low	34.8	Very low	192 Å²	192	132.8 Å²	132.8	90%	0.897	70%	0.699	S	S	*	*			trans	91.1	41.8	175.6	-50	-174.5	178.8	0	0	117.6
8	V	32.8	Very low	34.7	Very low	125 Å²	125	129.8 Å²	129.8	76%	0.758	69%	0.69	S	S	*	*			trans	-98.9	95.2	145.3	-173.7	0	0	0	0	106	E10	V8-E10 PolarHBondContact O-N 3.13Å
9	E	37.5	Very low	35	Very low	116 Å²	116	133.1 Å²	133.1	54%	0.542	70%	0.698	S	S	.	*			trans	-49.5	135.6	-177.3	-76.1	-164.3	166.3	0	0	111.6	D11 R251	E9-D11 PolarHBondContact O-N 3.43Å; E9-R251 IonicContact OE2-CZ 3.54Å; E9-R251 IonicContact OE2-NH1 2.74Å; E9-R251 PolarHBondContact OE2-NH1 3.35Å
10	E	35.9	Very low	34.7	Very low	181 Å²	181	133.3 Å²	133.3	85%	0.846	70%	0.704	S	S	*	*			trans	-60.3	68.5	173.8	-65.7	173.4	141.5	0	0	111.3	V8 E12	V8-E10 PolarHBondContact O-N 3.13Å; E10-E12 PolarHBondContact O-N 3.03Å
11	D	41.6	Very low	34.6	Very low	73 Å²	73	134.7 Å²	134.7	39%	0.39	71%	0.712	S	S	.	*			trans	-90.1	100.1	174.7	-96	-33.6	0	0	0	108.9	E9 R251 K252	E9-D11 PolarHBondContact O-N 3.43Å; D11-R251 IonicContact OD2-CZ 2.87Å; D11-R251 IonicContact OD2-NH1 3.59Å; D11-R251 PolarHBondContact OD2-NH1 3.26Å; D11-R251 VanDerWaalsContact OD2-NH1 3.15Å; D11-R251 IonicContact OD2-NH2 2.74Å; D11-K252 IonicContact OD1-NZ 3.52Å; D11-K252 PolarHBondContact OD1-NZ 3.36Å
12	E	47.3	Very low	34.5	Very low	107 Å²	107	129.1 Å²	129.1	50%	0.5	70%	0.697	S	S	.	*	S	Bend	trans	95.7	24.1	156.3	-47.7	-154.3	153.6	0	0	120.4	E10 E14 K93	E10-E12 PolarHBondContact O-N 3.03Å; E12-E14 PolarHBondContact O-N 2.95Å; E12-K93 WeakPolarHBondContact OE2-CE 3.47Å; E12-K93 IonicContact OE2-NZ 3.15Å; E12-K93 PolarHBondContact OE2-NZ 3.12Å
13	T	32	Very low	34.6	Very low	97 Å²	97	125.6 Å²	125.6	60%	0.595	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-73.6	-5.6	165.4	30.7	0	0	0	0	114.4	W15	T13-W15 VanDerWaalsContact C-N 3.34Å; T13-W15 PolarHBondContact O-N 3.35Å
14	E	41.4	Very low	34.6	Very low	114 Å²	114	124.2 Å²	124.2	53%	0.533	70%	0.697	S	S	.	*	G	3₁₀ helix	trans	-85.4	17.2	-177.2	-85.2	-171.9	152.4	0	0	116.1	E12 K16	E12-E14 PolarHBondContact O-N 2.95Å; E14-K16 PolarHBondContact O-N 3.34Å
15	W	42.2	Very low	34.7	Very low	155 Å²	155	125 Å²	125	59%	0.587	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-73.8	-7.2	175.6	69	-76.1	0	0	0	113.7	T13	T13-W15 VanDerWaalsContact C-N 3.34Å; T13-W15 PolarHBondContact O-N 3.35Å
16	K	32.3	Very low	34.3	Very low	147 Å²	147	124.6 Å²	124.6	64%	0.639	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-11.7	-179.7	-76.8	-173.8	175.7	178.1	0	115.7	E14	E14-K16 PolarHBondContact O-N 3.34Å
17	T	29.5	Very low	34.4	Very low	100 Å²	100	127.3 Å²	127.3	61%	0.613	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	0.1	-165.3	39.4	0	0	0	0	116.8	F19	T17-F19 PolarHBondContact O-N 3.45Å
18	C	32.5	Very low	34	Very low	78 Å²	78	123 Å²	123	53%	0.527	71%	0.705	S	S	.	*	S	Bend	trans	-94	33	-179.4	-71.3	0	0	0	0	115.3
19	F	41	Very low	34	Very low	193 Å²	193	123.7 Å²	123.7	85%	0.846	71%	0.71	S	S	*	*			trans	-150.6	89.7	169.7	-70.3	-73.8	0	0	0	112	T17	T17-F19 PolarHBondContact O-N 3.45Å
20	V	29.2	Very low	33.6	Very low	137 Å²	137	123.8 Å²	123.8	83%	0.83	72%	0.723	S	S	*	*	S	Bend	trans	-130.5	131.7	153.3	-173.2	0	0	0	0	107.2	S22	V20-S22 PolarHBondContact O-N 3.01Å
21	D	32.2	Very low	33.5	Very low	163 Å²	163	121.1 Å²	121.1	87%	0.872	72%	0.721	S	S	*	*			trans	-30.6	120.2	-169.6	-70.4	-45.9	0	0	0	116.1
22	S	30.9	Very low	33.2	Very low	124 Å²	124	122.7 Å²	122.7	87%	0.867	75%	0.745	S	S	*	*			trans	-107.5	111.1	157.5	-79.9	0	0	0	0	109.3	V20	V20-S22 PolarHBondContact O-N 3.01Å
23	A	29.1	Very low	32.5	Very low	91 Å²	91	122.4 Å²	122.4	75%	0.752	76%	0.761	S	S	*	*			trans	-57.5	146.1	178.5	0	0	0	0	0	112.3	V25	A23-V25 PolarHBondContact O-N 3.39Å
24	A	30.2	Very low	32.5	Very low	100 Å²	100	122.8 Å²	122.8	83%	0.826	77%	0.773	S	S	*	*			trans	-54.8	128.8	-178.7	0	0	0	0	0	113
25	V	28.5	Very low	32.2	Very low	138 Å²	138	123.1 Å²	123.1	84%	0.836	79%	0.789	S	S	*	*			trans	-120.7	112	163.2	-179	0	0	0	0	107.7	A23	A23-V25 PolarHBondContact O-N 3.39Å
26	C	27.9	Very low	31.7	Very low	117 Å²	117	118.2 Å²	118.2	79%	0.791	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.3	139.6	174.8	-57.6	0	0	0	0	110.9
27	P	32.8	Very low	31.7	Very low	125 Å²	125	117.6 Å²	117.6	81%	0.812	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-96.6	134.3	160.4	21.1	-6	0	0	0	111.4
28	A	28.1	Very low	31.8	Very low	102 Å²	102	118.7 Å²	118.7	84%	0.843	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.4	149.2	173.5	0	0	0	0	0	112.1
29	T	31.5	Very low	31.9	Very low	140 Å²	140	122.7 Å²	122.7	86%	0.859	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-61.1	141.9	-179.2	9.2	0	0	0	0	114
30	S	29.8	Very low	31.8	Very low	118 Å²	118	121.5 Å²	121.5	83%	0.825	82%	0.815	S	S	*	*			trans	-157.6	157.2	154.8	-88.4	0	0	0	0	112.3
31	P	33.8	Very low	32.6	Very low	124 Å²	124	119.1 Å²	119.1	81%	0.805	80%	0.804	S	S	*	*			trans	-101.7	168.8	-135.4	37.7	-35.4	0	0	0	116.1
32	A	35.8	Very low	33.8	Very low	106 Å²	106	115.2 Å²	115.2	88%	0.876	80%	0.795	S	S	*	*			trans	-40	134	-177.4	0	0	0	0	0	116.5
33	A	31.1	Very low	36.3	Very low	102 Å²	102	114.2 Å²	114.2	84%	0.843	78%	0.776	S	S	*	*			trans	-119.2	142.7	167.2	0	0	0	0	0	110.5
34	A	31.8	Very low	39.4	Very low	104 Å²	104	112.3 Å²	112.3	86%	0.86	75%	0.749	S	S	*	*			trans	-63.4	140.1	-160.3	0	0	0	0	0	115.8	G36	A34-G36 PolarHBondContact O-N 3.19Å
35	S	35.5	Very low	42.7	Very low	122 Å²	122	107.6 Å²	107.6	85%	0.853	71%	0.711	S	S	*	*			trans	-71.9	103.5	174.6	52.9	0	0	0	0	112
36	G	33	Very low	46	Very low	51 Å²	51	101 Å²	101	53%	0.526	67%	0.671	S	S	.	*			trans	-81.5	163	153.7	0	0	0	0	0	110.6	A34 V38	A34-G36 PolarHBondContact O-N 3.19Å; G36-V38 PolarHBondContact O-N 3.24Å
37	P	31.6	Very low	49.4	Very low	134 Å²	134	95.5 Å²	95.5	87%	0.87	63%	0.633	S	S	*	*			trans	-67.7	101.9	177	28.9	-31.5	0	0	0	108.8	I39	P37-I39 PolarHBondContact O-N 3.44Å
38	V	32.4	Very low	52.5	Low	124 Å²	124	89.5 Å²	89.5	75%	0.752	60%	0.595	S	S	*	*			trans	-66.5	114.7	169.1	-179	0	0	0	0	106.2	G36 E40	G36-V38 PolarHBondContact O-N 3.24Å; V38-E40 VanDerWaalsContact C-N 3.29Å; V38-E40 PolarHBondContact O-N 3.23Å
39	I	34.1	Very low	55.9	Low	161 Å²	161	84.9 Å²	84.9	83%	0.826	56%	0.555	S	S	*	*			trans	-63.8	100.7	163.7	-61.6	173.6	0	0	0	104.7	P37 S41	P37-I39 PolarHBondContact O-N 3.44Å; I39-S41 VanDerWaalsContact C-N 3.34Å; I39-S41 PolarHBondContact O-N 3.08Å
40	E	38.7	Very low	59.1	Low	168 Å²	168	79.2 Å²	79.2	79%	0.785	52%	0.52	S	S	*	.			trans	-55.6	98.2	175.6	-77.2	-179.7	160.5	0	0	108.5	V38 A42	V38-E40 VanDerWaalsContact C-N 3.29Å; V38-E40 PolarHBondContact O-N 3.23Å; E40-A42 PolarHBondContact O-N 3.18Å; E40-A42 VanDerWaalsContact O-N 3.07Å
41	S	45.4	Very low	62.4	Low	87 Å²	87	73.8 Å²	73.8	61%	0.608	48%	0.481	S	S	*	.			trans	-62.9	110.9	161.9	58.5	0	0	0	0	105.7	I39 H43	I39-S41 VanDerWaalsContact C-N 3.34Å; I39-S41 PolarHBondContact O-N 3.08Å; S41-H43 PolarHBondContact O-N 3.36Å
42	A	58.1	Low	65.4	Low	82 Å²	82	67.9 Å²	67.9	68%	0.678	44%	0.443	S	S	*	.			trans	-44.8	114.6	175.7	0	0	0	0	0	109.2	E40 R44	E40-A42 PolarHBondContact O-N 3.18Å; E40-A42 VanDerWaalsContact O-N 3.07Å; A42-R44 PolarHBondContact O-N 2.65Å
43	H	82.3	Confident	68.4	Low	103 Å²	103	63.2 Å²	63.2	48%	0.477	40%	0.404	S	S	.	.			trans	-67.1	97.9	-171.4	-72.3	-85	0	0	0	109.3	S41	S41-H43 PolarHBondContact O-N 3.36Å
44	R	95.6	Very high	71.6	Confident	50 Å²	50	58.6 Å²	58.6	19%	0.189	37%	0.365	C	S	.	.			trans	-58.4	148.1	176.6	-68.3	-177.1	-69.7	157	-3.5	110.2	A42 I46 T149 T215 D303 S305	A42-R44 PolarHBondContact O-N 2.65Å; R44-I46 HydrophobicContact CB-CD1 4.11Å; R44-I46 HydrophobicContact CB-CG1 4.27Å; R44-T149 VanDerWaalsContact CA-OG1 3.31Å; R44-T149 WeakPolarHBondContact CA-OG1 3.4Å; R44-T215 WeakPolarHBondContact O-CA 3.42Å; R44-D303 PolarHBondContact NH2-O 3.03Å; R44-S305 PolarHBondContact NH1-O 3.49Å
45	V	98.1	Very high	74.8	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.012	33%	0.332	C	S	.	.			trans	-119.6	109	168.4	-176.7	0	0	0	0	107.9	V148 T149 V152 R186 L187 V213	V45-V148 HydrophobicContact CB-CG2 4.06Å; V45-V148 HydrophobicContact CG1-CG2 3.72Å; V45-V148 WeakPolarHBondContact O-CG2 3.42Å; V45-V148 PolarHBondContact O-N 3.24Å; V45-T149 PolarHBondContact N-OG1 2.8Å; V45-V152 HydrophobicContact CB-CG2 4.08Å; V45-V152 HydrophobicContact CG1-CG2 4.1Å; V45-V152 HydrophobicContact CG2-CB 4.47Å; V45-V152 HydrophobicContact CG2-CG1 4.26Å; V45-V152 HydrophobicContact CG2-CG2 4.17Å; V45-R186 HydrophobicContact CG2-CB 3.83Å; V45-L187 HydrophobicContact CG1-CD2 4.41Å; V45-V213 HydrophobicContact CG1-CG1 4.13Å
46	I	98.7	Very high	77.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.2	-176.3	-54.1	-53.5	0	0	0	109	R44 F145 D147 A214 K217 A220 V307	R44-I46 HydrophobicContact CB-CD1 4.11Å; R44-I46 HydrophobicContact CB-CG1 4.27Å; I46-F145 HydrophobicContact CG2-CD1 4.28Å; I46-D147 HydrophobicContact CD1-CB 3.8Å; I46-D147 VanDerWaalsContact CD1-CG 3.49Å; I46-D147 WeakPolarHBondContact CD1-OD2 3.43Å; I46-A214 PolarHBondContact N-O 2.88Å; I46-A214 PolarHBondContact O-N 3.15Å; I46-K217 HydrophobicContact CG2-CG 4.08Å; I46-A220 HydrophobicContact CB-CB 4.41Å; I46-A220 HydrophobicContact CG2-CB 4.1Å; I46-V307 HydrophobicContact CD1-CG2 3.96Å; I46-V307 HydrophobicContact CG2-CG2 4.14Å
47	L	98.8	Very high	80.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	142.5	171.1	-48	-174.1	0	0	0	109.2	F49 F145 V146 V148 I193 A194 M197 G212 V213	L47-F49 HydrophobicContact CB-CD2 4.45Å; L47-F49 HydrophobicContact CB-CE2 3.76Å; L47-F49 HydrophobicContact CB-CZ 4.36Å; L47-F49 HydrophobicContact CD1-CE2 4.06Å; L47-F49 HydrophobicContact CD1-CZ 4.05Å; L47-F145 CarbonylContact O-C 3.56Å; L47-F145 VanDerWaalsContact O-CA 3.24Å; L47-F145 WeakPolarHBondContact O-CA 3.17Å; L47-V146 HydrophobicContact CB-CB 4.27Å; L47-V146 PolarHBondContact N-O 3.09Å; L47-V146 PolarHBondContact O-N 3.46Å; L47-V148 HydrophobicContact CD1-CB 4.42Å; L47-V148 HydrophobicContact CD1-CG1 3.57Å; L47-V148 HydrophobicContact CD1-CG2 4.01Å; L47-V148 HydrophobicContact CD2-CG2 3.97Å; L47-V148 HydrophobicContact CG-CB 4.49Å; L47-V148 HydrophobicContact CG-CG1 3.9Å; L47-V148 HydrophobicContact CG-CG2 3.75Å; L47-I193 HydrophobicContact CD1-CG2 3.88Å; L47-A194 HydrophobicContact CD1-CB 4.08Å; L47-A194 HydrophobicContact CD2-CB 4.12Å; L47-M197 HydrophobicContact CD1-SD 3.89Å; L47-G212 CarbonylContact C-O 3.6Å; L47-G212 WeakPolarHBondContact CA-O 3.48Å; L47-V213 HydrophobicContact CD2-CB 4.2Å; L47-V213 HydrophobicContact CD2-CG1 3.8Å; L47-V213 HydrophobicContact CD2-CG2 3.85Å
48	H	98.9	Very high	84.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	126	167.2	172.5	-102.1	0	0	0	108.8	E143 N144 F145 A211 G212 A220 S224	H48-E143 IonicContact CE1-OE2 2.73Å; H48-E143 IonicContact NE2-OE2 3.98Å; H48-E143 PolarHBondContact NE2-OE2 3.24Å; H48-N144 CarbonylContact C-O 3.55Å; H48-N144 WeakPolarHBondContact CA-O 3.33Å; H48-F145 HydrophobicContact CB-CD1 3.88Å; H48-F145 HydrophobicContact CB-CE1 3.84Å; H48-F145 AromaticContact CD2-CD1 3.76Å; H48-F145 AromaticContact CD2-CE1 3.33Å; H48-F145 WeakPolarHBondContact CD2-CE1 3.23Å; H48-F145 AromaticContact CD2-CE2 3.99Å; H48-F145 AromaticContact CD2-CZ 3.48Å; H48-F145 VanDerWaalsContact CD2-CZ 3.48Å; H48-F145 WeakPolarHBondContact CD2-CZ 3.29Å; H48-F145 AromaticContact CG-CE1 3.84Å; H48-A211 CarbonylContact O-C 3.55Å; H48-A211 WeakPolarHBondContact O-CA 3.26Å; H48-G212 PolarHBondContact N-O 3.44Å; H48-G212 PolarHBondContact O-N 3.24Å; H48-A220 HydrophobicContact CB-CB 3.78Å; H48-S224 PolarHBondContact CE1-OG 3.13Å; H48-S224 WeakPolarHBondContact ND1-CB 3.43Å; H48-S224 PolarHBondContact ND1-OG 3.29Å
49	F	98.8	Very high	87.3	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.7	174.5	-63.7	-93.9	0	0	0	109.5	L47 L129 E143 N144 V146 M197 R198 I201 C210 A211	L47-F49 HydrophobicContact CB-CD2 4.45Å; L47-F49 HydrophobicContact CB-CE2 3.76Å; L47-F49 HydrophobicContact CB-CZ 4.36Å; L47-F49 HydrophobicContact CD1-CE2 4.06Å; L47-F49 HydrophobicContact CD1-CZ 4.05Å; F49-L129 HydrophobicContact CD2-CD1 4.22Å; F49-L129 HydrophobicContact CD2-CD2 4.35Å; F49-L129 HydrophobicContact CE2-CD2 4.08Å; F49-L129 HydrophobicContact CZ-CD2 4.26Å; F49-E143 WeakPolarHBondContact O-CA 3.49Å; F49-N144 PolarHBondContact N-O 3.24Å; F49-N144 PolarHBondContact O-N 3.03Å; F49-V146 HydrophobicContact CD2-CG2 4.07Å; F49-V146 HydrophobicContact CE2-CB 4.5Å; F49-V146 HydrophobicContact CE2-CG2 3.79Å; F49-M197 HydrophobicContact CE1-CB 3.78Å; F49-M197 HydrophobicContact CE2-SD 3.88Å; F49-M197 HydrophobicContact CZ-CB 3.52Å; F49-M197 HydrophobicContact CZ-CG 4.19Å; F49-M197 HydrophobicContact CZ-SD 3.58Å; F49-M197 VanDerWaalsContact CZ-SD 3.58Å; F49-R198 HydrophobicContact CD1-CG 4.07Å; F49-R198 HydrophobicContact CE1-CG 3.82Å; F49-I201 HydrophobicContact CD1-CD1 4.26Å; F49-C210 WeakPolarHBondContact CA-O 3.47Å; F49-A211 HydrophobicContact CD1-CB 3.99Å; F49-A211 HydrophobicContact CE1-CB 4.04Å
50	D	98.7	Very high	90.3	Very high	21 Å²	21	30.1 Å²	30.1	11%	0.112	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	111.5	176.9	167.3	-23.3	0	0	0	107.9	E143 G209 C210 K228	D50-E143 HydrophobicContact CB-CG 4.45Å; D50-G209 CarbonylContact O-C 3.54Å; D50-G209 VanDerWaalsContact O-CA 3.24Å; D50-G209 WeakPolarHBondContact O-CA 3.38Å; D50-C210 PolarHBondContact N-O 3.26Å; D50-C210 PolarHBondContact O-N 3Å; D50-K228 IonicContact OD1-NZ 2.81Å; D50-K228 PolarHBondContact OD1-NZ 2.94Å; D50-K228 IonicContact OD2-NZ 3.34Å; D50-K228 PolarHBondContact OD2-NZ 2.88Å
51	L	98.7	Very high	93.2	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	139.4	-175.8	-58.2	172.7	0	0	0	112.3	C53 F54 V125 D142 I201 L207	L51-C53 PolarHBondContact O-N 2.78Å; L51-F54 HydrophobicContact CB-CB 4.29Å; L51-F54 HydrophobicContact CB-CD2 4.04Å; L51-F54 HydrophobicContact CB-CG 4.49Å; L51-F54 HydrophobicContact CD1-CD2 3.48Å; L51-F54 VanDerWaalsContact CD1-CD2 3.48Å; L51-F54 HydrophobicContact CD1-CE2 3.59Å; L51-F54 HydrophobicContact CD1-CG 4.37Å; L51-F54 HydrophobicContact CG-CD2 4.43Å; L51-V125 HydrophobicContact CD1-CG1 4.41Å; L51-V125 HydrophobicContact CD1-CG2 3.99Å; L51-D142 HydrophobicContact CB-CB 4.06Å; L51-D142 HydrophobicContact CD1-CB 4.42Å; L51-D142 HydrophobicContact CG-CB 4.48Å; L51-D142 WeakPolarHBondContact CG-O 3.35Å; L51-D142 PolarHBondContact N-O 3.46Å; L51-I201 HydrophobicContact CD2-CG2 4.22Å; L51-L207 HydrophobicContact CD1-CD1 4.08Å; L51-L207 HydrophobicContact CD2-CB 4.49Å
52	D	98.2	Very high	95.7	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	120.2	-177.4	-78.7	-48.3	0	0	0	111.5	F54 Q57 Y84 T208 G209 P229 N230	D52-F54 PolarHBondContact O-N 2.95Å; D52-Q57 PolarHBondContact O-NE2 3.1Å; D52-Y84 HydrophobicContact CB-CE2 3.92Å; D52-Y84 PolarHBondContact OD1-OH 3.13Å; D52-T208 PolarHBondContact N-O 2.89Å; D52-T208 PolarHBondContact OD2-OG1 3.47Å; D52-G209 WeakPolarHBondContact OD2-CA 3.35Å; D52-G209 PolarHBondContact OD2-N 2.64Å; D52-P229 WeakPolarHBondContact OD1-CA 3.31Å; D52-P229 WeakPolarHBondContact OD1-CB 3.38Å; D52-N230 PolarHBondContact OD1-N 3.31Å; D52-N230 WeakPolarHBondContact OD2-CA 3.17Å; D52-N230 WeakPolarHBondContact OD2-CB 3.28Å; D52-N230 PolarHBondContact OD2-N 3.08Å
53	C	97.7	Very high	97.6	Very high	8 Å²	8	26.3 Å²	26.3	5%	0.054	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	40.7	48.1	174.5	57.4	0	0	0	0	113.2	L51 Y55 A56 Q57 C82 Y84	L51-C53 PolarHBondContact O-N 2.78Å; C53-Y55 PolarHBondContact O-N 3.07Å; C53-Y55 VanDerWaalsContact O-N 3.08Å; C53-A56 HydrophobicContact CB-CB 4.27Å; C53-A56 WeakPolarHBondContact O-CA 3.46Å; C53-A56 WeakPolarHBondContact O-CB 3.48Å; C53-A56 PolarHBondContact O-N 2.9Å; C53-Q57 PolarHBondContact O-N 3.47Å; C53-C82 WeakPolarHBondContact CB-O 3.33Å; C53-Y84 HydrophobicContact CB-CE2 4.32Å
54	F	98.8	Very high	98.3	Very high	5 Å²	5	24.8 Å²	24.8	2%	0.022	12%	0.119	C	C	.	.	H	α-helix	trans	-43.1	-53.3	-157.1	178.2	-124.3	0	0	0	116.1	L51 D52 A56 Q57 V58 Y118 M121 F141 D142 L207	L51-F54 HydrophobicContact CB-CB 4.29Å; L51-F54 HydrophobicContact CB-CD2 4.04Å; L51-F54 HydrophobicContact CB-CG 4.49Å; L51-F54 HydrophobicContact CD1-CD2 3.48Å; L51-F54 VanDerWaalsContact CD1-CD2 3.48Å; L51-F54 HydrophobicContact CD1-CE2 3.59Å; L51-F54 HydrophobicContact CD1-CG 4.37Å; L51-F54 HydrophobicContact CG-CD2 4.43Å; D52-F54 PolarHBondContact O-N 2.95Å; F54-A56 VanDerWaalsContact C-N 3.35Å; F54-A56 PolarHBondContact O-N 3.26Å; F54-Q57 WeakPolarHBondContact O-CB 3.41Å; F54-Q57 PolarHBondContact O-N 2.97Å; F54-Q57 VanDerWaalsContact O-N 3.13Å; F54-V58 HydrophobicContact CD2-CG2 4.12Å; F54-V58 HydrophobicContact CE2-CG2 3.72Å; F54-V58 HydrophobicContact CZ-CG2 4.01Å; F54-V58 WeakPolarHBondContact O-CG2 3.2Å; F54-V58 PolarHBondContact O-N 3.27Å; F54-Y118 WeakPolarHBondContact CE1-O 3.48Å; F54-Y118 VanDerWaalsContact CZ-O 3.24Å; F54-Y118 WeakPolarHBondContact CZ-O 3.26Å; F54-M121 HydrophobicContact CE2-CB 4.4Å; F54-M121 HydrophobicContact CE2-CG 3.97Å; F54-M121 HydrophobicContact CZ-CB 4.17Å; F54-M121 HydrophobicContact CZ-CG 4.24Å; F54-F141 HydrophobicContact CD1-CB 4.2Å; F54-F141 HydrophobicContact CE1-CB 3.81Å; F54-D142 HydrophobicContact CB-CB 3.54Å; F54-D142 HydrophobicContact CD1-CB 3.83Å; F54-D142 HydrophobicContact CD2-CB 4.32Å; F54-D142 HydrophobicContact CG-CB 3.65Å; F54-L207 HydrophobicContact CD2-CD2 4.48Å; F54-L207 HydrophobicContact CE2-CD1 4.42Å; F54-L207 HydrophobicContact CE2-CD2 4.44Å
55	Y	98.8	Very high	98.4	Very high	40 Å²	40	26 Å²	26	16%	0.157	14%	0.139	C	C	.	.	H	α-helix	trans	-64.6	-39.8	-178.4	-64.8	2.6	0	0	0	112.1	C53 Q57 V58 E59 I73 V80 L115 Y118 F141	C53-Y55 PolarHBondContact O-N 3.07Å; C53-Y55 VanDerWaalsContact O-N 3.08Å; Y55-Q57 VanDerWaalsContact C-N 3.29Å; Y55-Q57 PolarHBondContact O-N 2.8Å; Y55-V58 PolarHBondContact O-N 3.45Å; Y55-E59 WeakPolarHBondContact O-CG 3.5Å; Y55-E59 PolarHBondContact O-N 2.92Å; Y55-I73 HydrophobicContact CD2-CG2 4.26Å; Y55-V80 HydrophobicContact CD2-CG1 3.86Å; Y55-V80 HydrophobicContact CE2-CG1 4.34Å; Y55-L115 HydrophobicContact CE2-CD2 3.86Å; Y55-Y118 AromaticContact CD1-CD1 3.81Å; Y55-Y118 HydrophobicContact CD1-CD1 3.81Å; Y55-Y118 AromaticContact CD1-CD2 3.78Å; Y55-Y118 HydrophobicContact CD1-CD2 3.78Å; Y55-Y118 HydrophobicContact CD1-CE1 4.41Å; Y55-Y118 HydrophobicContact CD1-CE2 4.37Å; Y55-Y118 AromaticContact CD1-CG 3.5Å; Y55-Y118 HydrophobicContact CD1-CG 3.5Å; Y55-Y118 VanDerWaalsContact CD1-CG 3.5Å; Y55-Y118 AromaticContact CD2-CD2 3.73Å; Y55-Y118 HydrophobicContact CD2-CD2 3.73Å; Y55-Y118 AromaticContact CD2-CE2 3.7Å; Y55-Y118 HydrophobicContact CD2-CE2 3.7Å; Y55-Y118 HydrophobicContact CD2-CG 4.29Å; Y55-Y118 HydrophobicContact CE1-CD1 4.49Å; Y55-Y118 AromaticContact CE1-CD2 3.86Å; Y55-Y118 HydrophobicContact CE1-CD2 3.86Å; Y55-Y118 AromaticContact CE1-CG 3.74Å; Y55-Y118 HydrophobicContact CE1-CG 3.74Å; Y55-Y118 AromaticContact CE2-CD2 3.78Å; Y55-Y118 HydrophobicContact CE2-CD2 3.78Å; Y55-Y118 HydrophobicContact CE2-CE2 4.09Å; Y55-Y118 HydrophobicContact CE2-CG 4.47Å; Y55-Y118 AromaticContact CG-CD1 3.96Å; Y55-Y118 HydrophobicContact CG-CD1 3.96Å; Y55-Y118 AromaticContact CG-CD2 3.74Å; Y55-Y118 HydrophobicContact CG-CD2 3.74Å; Y55-Y118 HydrophobicContact CG-CE1 4.1Å; Y55-Y118 AromaticContact CG-CE2 3.87Å; Y55-Y118 HydrophobicContact CG-CE2 3.87Å; Y55-Y118 AromaticContact CG-CG 3.82Å; Y55-Y118 HydrophobicContact CG-CG 3.82Å; Y55-Y118 AromaticContact CZ-CD2 3.85Å; Y55-F141 HydrophobicContact CE1-CD2 4.07Å
56	A	98.6	Very high	98.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-39.4	175.2	0	0	0	0	0	110.9	C53 F54 E59 M60 L71 I73 T81 N83	C53-A56 HydrophobicContact CB-CB 4.27Å; C53-A56 WeakPolarHBondContact O-CA 3.46Å; C53-A56 WeakPolarHBondContact O-CB 3.48Å; C53-A56 PolarHBondContact O-N 2.9Å; F54-A56 VanDerWaalsContact C-N 3.35Å; F54-A56 PolarHBondContact O-N 3.26Å; A56-E59 PolarHBondContact O-N 3.43Å; A56-M60 WeakPolarHBondContact O-CB 3.33Å; A56-M60 VanDerWaalsContact O-CG 3.24Å; A56-M60 WeakPolarHBondContact O-CG 3.26Å; A56-M60 PolarHBondContact O-N 2.94Å; A56-L71 HydrophobicContact CB-CD2 4.04Å; A56-I73 HydrophobicContact CB-CD1 4.41Å; A56-I73 HydrophobicContact CB-CG1 3.98Å; A56-T81 HydrophobicContact CB-CG2 4.39Å; A56-N83 HydrophobicContact CB-CB 4.15Å
57	Q	98.6	Very high	98.3	Very high	16 Å²	16	32.6 Å²	32.6	8%	0.075	17%	0.165	C	C	.	.	H	α-helix	trans	-66	-40.8	177.3	-161.8	171.3	87.7	0	0	112.8	D52 C53 F54 Y55 E59 M60 I61 L207 T208	D52-Q57 PolarHBondContact O-NE2 3.1Å; C53-Q57 PolarHBondContact O-N 3.47Å; F54-Q57 WeakPolarHBondContact O-CB 3.41Å; F54-Q57 PolarHBondContact O-N 2.97Å; F54-Q57 VanDerWaalsContact O-N 3.13Å; Y55-Q57 VanDerWaalsContact C-N 3.29Å; Y55-Q57 PolarHBondContact O-N 2.8Å; Q57-E59 VanDerWaalsContact C-N 3.35Å; Q57-E59 PolarHBondContact O-N 3.43Å; Q57-M60 HydrophobicContact CB-CE 4.17Å; Q57-M60 HydrophobicContact CG-CE 4.31Å; Q57-M60 PolarHBondContact O-N 3.48Å; Q57-I61 HydrophobicContact CG-CD1 4.49Å; Q57-I61 VanDerWaalsContact O-CG1 3.32Å; Q57-I61 WeakPolarHBondContact O-CG1 3.5Å; Q57-I61 PolarHBondContact O-N 3.27Å; Q57-L207 HydrophobicContact CB-CD2 4.31Å; Q57-L207 HydrophobicContact CG-CD2 3.94Å; Q57-T208 PolarHBondContact NE2-OG1 2.96Å; Q57-T208 PolarHBondContact OE1-O 2.91Å
58	V	98.7	Very high	98.2	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-44.5	173	174.4	0	0	0	0	111	F54 Y55 M60 I61 R62 H117 Y118 M121 L207	F54-V58 HydrophobicContact CD2-CG2 4.12Å; F54-V58 HydrophobicContact CE2-CG2 3.72Å; F54-V58 HydrophobicContact CZ-CG2 4.01Å; F54-V58 WeakPolarHBondContact O-CG2 3.2Å; F54-V58 PolarHBondContact O-N 3.27Å; Y55-V58 PolarHBondContact O-N 3.45Å; V58-M60 PolarHBondContact O-N 3.4Å; V58-I61 PolarHBondContact O-N 2.73Å; V58-R62 VanDerWaalsContact O-CG 3.32Å; V58-R62 WeakPolarHBondContact O-CG 3.43Å; V58-R62 PolarHBondContact O-N 3.39Å; V58-H117 HydrophobicContact CG1-CB 4.35Å; V58-Y118 HydrophobicContact CB-CD1 3.72Å; V58-Y118 HydrophobicContact CB-CE1 3.94Å; V58-Y118 HydrophobicContact CG1-CD1 3.69Å; V58-Y118 HydrophobicContact CG1-CE1 3.91Å; V58-Y118 HydrophobicContact CG2-CD1 4.09Å; V58-M121 HydrophobicContact CG2-CB 4.06Å; V58-M121 HydrophobicContact CG2-CG 3.91Å; V58-L207 HydrophobicContact CG2-CD2 4.46Å
59	E	98.6	Very high	98.2	Very high	13 Å²	13	41.8 Å²	41.8	6%	0.061	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-36.9	176.1	-65.9	-51.6	143.4	0	0	112.8	Y55 A56 Q57 I61 R62 N63 L66 L71 I73 V110 Y118	Y55-E59 WeakPolarHBondContact O-CG 3.5Å; Y55-E59 PolarHBondContact O-N 2.92Å; A56-E59 PolarHBondContact O-N 3.43Å; Q57-E59 VanDerWaalsContact C-N 3.35Å; Q57-E59 PolarHBondContact O-N 3.43Å; E59-I61 VanDerWaalsContact C-N 3.29Å; E59-I61 PolarHBondContact O-N 3.31Å; E59-R62 PolarHBondContact O-N 2.94Å; E59-R62 IonicContact OE1-NH1 3.96Å; E59-R62 PolarHBondContact OE1-NH1 3.3Å; E59-R62 IonicContact OE2-CZ 3.16Å; E59-R62 IonicContact OE2-NH1 3.87Å; E59-R62 PolarHBondContact OE2-NH1 2.97Å; E59-R62 VanDerWaalsContact OE2-NH1 3.13Å; E59-N63 PolarHBondContact O-N 3.32Å; E59-L66 HydrophobicContact CB-CD1 4.31Å; E59-L71 HydrophobicContact CB-CD2 4.26Å; E59-I73 HydrophobicContact CB-CD1 4.14Å; E59-I73 HydrophobicContact CG-CD1 3.63Å; E59-V110 HydrophobicContact CG-CB 4.41Å; E59-V110 HydrophobicContact CG-CG1 3.83Å; E59-Y118 HydrophobicContact CG-CE1 4.25Å; E59-Y118 VanDerWaalsContact OE1-CE1 3.28Å; E59-Y118 WeakPolarHBondContact OE1-CE1 3.44Å; E59-Y118 PolarHBondContact OE1-OH 3.09Å
60	M	98.6	Very high	98.2	Very high	24 Å²	24	41.8 Å²	41.8	12%	0.118	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-23.3	174.6	-72.6	-175.5	-55.9	0	0	113.7	A56 Q57 V58 N63 P64 L66 R67 L71 N83	A56-M60 WeakPolarHBondContact O-CB 3.33Å; A56-M60 VanDerWaalsContact O-CG 3.24Å; A56-M60 WeakPolarHBondContact O-CG 3.26Å; A56-M60 PolarHBondContact O-N 2.94Å; Q57-M60 HydrophobicContact CB-CE 4.17Å; Q57-M60 HydrophobicContact CG-CE 4.31Å; Q57-M60 PolarHBondContact O-N 3.48Å; V58-M60 PolarHBondContact O-N 3.4Å; M60-N63 CarbonylContact O-C 3.47Å; M60-P64 WeakPolarHBondContact O-CA 3.42Å; M60-L66 HydrophobicContact CG-CB 4.11Å; M60-R67 HydrophobicContact CB-CG 3.85Å; M60-R67 HydrophobicContact CG-CG 4.21Å; M60-R67 PolarHBondContact O-NE 2.81Å; M60-R67 VanDerWaalsContact O-NE 3.12Å; M60-R67 HydrophobicContact SD-CG 4.35Å; M60-L71 HydrophobicContact CG-CD2 3.82Å; M60-N83 HydrophobicContact CE-CB 4.02Å; M60-N83 HydrophobicContact SD-CB 3.9Å
61	I	98	Very high	98.2	Very high	51 Å²	51	40.8 Å²	40.8	26%	0.262	21%	0.211	S	C	.	.	H	α-helix	trans	-76.2	-45.5	170.4	-70.4	163	0	0	0	109.7	Q57 V58 E59 L207	Q57-I61 HydrophobicContact CG-CD1 4.49Å; Q57-I61 VanDerWaalsContact O-CG1 3.32Å; Q57-I61 WeakPolarHBondContact O-CG1 3.5Å; Q57-I61 PolarHBondContact O-N 3.27Å; V58-I61 PolarHBondContact O-N 2.73Å; E59-I61 VanDerWaalsContact C-N 3.29Å; E59-I61 PolarHBondContact O-N 3.31Å; I61-L207 HydrophobicContact CD1-CD2 3.58Å; I61-L207 HydrophobicContact CD1-CG 4.02Å
62	R	97.7	Very high	98.2	Very high	131 Å²	131	40.6 Å²	40.6	49%	0.494	21%	0.21	S	C	.	.	H	α-helix	trans	-67.2	-37.2	179.8	-68.1	172.8	70.6	-158.2	5.5	112.6	V58 E59 H117	V58-R62 VanDerWaalsContact O-CG 3.32Å; V58-R62 WeakPolarHBondContact O-CG 3.43Å; V58-R62 PolarHBondContact O-N 3.39Å; E59-R62 PolarHBondContact O-N 2.94Å; E59-R62 IonicContact OE1-NH1 3.96Å; E59-R62 PolarHBondContact OE1-NH1 3.3Å; E59-R62 IonicContact OE2-CZ 3.16Å; E59-R62 IonicContact OE2-NH1 3.87Å; E59-R62 PolarHBondContact OE2-NH1 2.97Å; E59-R62 VanDerWaalsContact OE2-NH1 3.13Å; R62-H117 PolarHBondContact NH1-CD2 3.03Å; R62-H117 VanDerWaalsContact NH1-CD2 3.3Å; R62-H117 PolarHBondContact NH2-CD2 3.43Å; R62-H117 PolarHBondContact NH2-NE2 3.06Å
63	N	98.1	Very high	98.2	Very high	75 Å²	75	40.6 Å²	40.6	40%	0.401	21%	0.21	S	C	.	.			trans	-131	94.4	176.2	-176.9	0.5	0	0	0	110.3	E59 M60 A65 L66	E59-N63 PolarHBondContact O-N 3.32Å; M60-N63 CarbonylContact O-C 3.47Å; N63-A65 PolarHBondContact O-N 2.86Å; N63-A65 VanDerWaalsContact O-N 3.09Å; N63-A65 WeakPolarHBondContact OD1-CB 3.48Å; N63-A65 PolarHBondContact OD1-N 3.11Å; N63-L66 HydrophobicContact CB-CD1 3.88Å; N63-L66 HydrophobicContact CB-CG 4.04Å; N63-L66 WeakPolarHBondContact O-CB 3.29Å; N63-L66 PolarHBondContact O-N 3.29Å
64	P	97.8	Very high	98.2	Very high	72 Å²	72	42.3 Å²	42.3	47%	0.468	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-58.2	-22.8	-178.7	-28.2	36.5	0	0	0	115.4	M60 L66 R67	M60-P64 WeakPolarHBondContact O-CA 3.42Å; P64-L66 PolarHBondContact O-N 3.28Å; P64-L66 VanDerWaalsContact O-N 3.14Å; P64-R67 WeakPolarHBondContact O-CG 3.48Å; P64-R67 PolarHBondContact O-N 3.5Å
65	A	97.9	Very high	98.1	Very high	74 Å²	74	44.8 Å²	44.8	61%	0.612	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-64.6	-14.8	176.6	0	0	0	0	0	113.2	N63	N63-A65 PolarHBondContact O-N 2.86Å; N63-A65 VanDerWaalsContact O-N 3.09Å; N63-A65 WeakPolarHBondContact OD1-CB 3.48Å; N63-A65 PolarHBondContact OD1-N 3.11Å
66	L	98.1	Very high	97.9	Very high	17 Å²	17	46.2 Å²	46.2	9%	0.089	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-85.6	-4.9	179.8	-58.8	178.6	0	0	0	114.1	E59 M60 N63 P64 V69 L71 V108 V110	E59-L66 HydrophobicContact CB-CD1 4.31Å; M60-L66 HydrophobicContact CG-CB 4.11Å; N63-L66 HydrophobicContact CB-CD1 3.88Å; N63-L66 HydrophobicContact CB-CG 4.04Å; N63-L66 WeakPolarHBondContact O-CB 3.29Å; N63-L66 PolarHBondContact O-N 3.29Å; P64-L66 PolarHBondContact O-N 3.28Å; P64-L66 VanDerWaalsContact O-N 3.14Å; L66-V69 HydrophobicContact CD2-CG2 4.4Å; L66-L71 HydrophobicContact CB-CD2 4.17Å; L66-L71 HydrophobicContact CD1-CD1 4.27Å; L66-L71 HydrophobicContact CD1-CD2 4.32Å; L66-V108 HydrophobicContact CD2-CG1 3.95Å; L66-V110 HydrophobicContact CD1-CG2 3.89Å
67	R	96.6	Very high	97.8	Very high	125 Å²	125	52.5 Å²	52.5	47%	0.472	26%	0.26	S	S	.	.	S	Bend	trans	-67.5	-43.1	-172.5	-73.4	174.8	-173.8	-173.4	1	113.6	M60 P64	M60-R67 HydrophobicContact CB-CG 3.85Å; M60-R67 HydrophobicContact CG-CG 4.21Å; M60-R67 PolarHBondContact O-NE 2.81Å; M60-R67 VanDerWaalsContact O-NE 3.12Å; M60-R67 HydrophobicContact SD-CG 4.35Å; P64-R67 WeakPolarHBondContact O-CG 3.48Å; P64-R67 PolarHBondContact O-N 3.5Å
68	D	96.8	Very high	97.7	Very high	143 Å²	143	55.6 Å²	55.6	77%	0.765	28%	0.277	S	S	*	.	S	Bend	trans	-100.5	5.3	-169.9	-54.1	-47.1	0	0	0	112.9
69	V	98.1	Very high	97.7	Very high	49 Å²	49	55.4 Å²	55.4	30%	0.297	28%	0.275	S	S	.	.	S	Bend	trans	-109.5	152.2	177.5	-59.4	0	0	0	0	110.3	L66 L71 N83 V108	L66-V69 HydrophobicContact CD2-CG2 4.4Å; V69-L71 PolarHBondContact O-N 3.2Å; V69-L71 VanDerWaalsContact O-N 3.11Å; V69-N83 PolarHBondContact O-ND2 3.36Å; V69-V108 HydrophobicContact CB-CG2 4.28Å; V69-V108 HydrophobicContact CG2-CB 4.37Å; V69-V108 HydrophobicContact CG2-CG2 3.94Å
70	P	98.6	Very high	97.6	Very high	5 Å²	5	56.3 Å²	56.3	3%	0.032	28%	0.281	C	S	.	.			trans	-64.8	116.8	173.1	24.6	-29.8	0	0	0	108.8	V85 A86 E106 L107 V108	P70-V85 HydrophobicContact CB-CG1 4.39Å; P70-A86 HydrophobicContact CB-CB 3.86Å; P70-E106 HydrophobicContact CG-CG 3.74Å; P70-L107 HydrophobicContact CB-CD1 4.05Å; P70-V108 PolarHBondContact O-N 3.31Å
71	L	98.8	Very high	97.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	127	-177.1	174.1	66.8	0	0	0	110.4	A56 E59 M60 L66 V69 I73 C82 N83 V108 V110	A56-L71 HydrophobicContact CB-CD2 4.04Å; E59-L71 HydrophobicContact CB-CD2 4.26Å; M60-L71 HydrophobicContact CG-CD2 3.82Å; L66-L71 HydrophobicContact CB-CD2 4.17Å; L66-L71 HydrophobicContact CD1-CD1 4.27Å; L66-L71 HydrophobicContact CD1-CD2 4.32Å; V69-L71 PolarHBondContact O-N 3.2Å; V69-L71 VanDerWaalsContact O-N 3.11Å; L71-I73 HydrophobicContact CD1-CD1 4.27Å; L71-I73 HydrophobicContact CD2-CD1 4.19Å; L71-I73 HydrophobicContact CG-CD1 4.18Å; L71-C82 CarbonylContact O-C 3.54Å; L71-C82 WeakPolarHBondContact O-CA 3.38Å; L71-C82 VanDerWaalsContact O-CB 3.26Å; L71-C82 WeakPolarHBondContact O-CB 3.4Å; L71-N83 HydrophobicContact CB-CB 4.31Å; L71-N83 PolarHBondContact N-OD1 3.26Å; L71-N83 PolarHBondContact O-N 2.92Å; L71-N83 PolarHBondContact O-OD1 3Å; L71-V108 WeakPolarHBondContact CA-O 3.43Å; L71-V108 HydrophobicContact CD1-CG1 4.45Å; L71-V110 HydrophobicContact CD1-CB 4.22Å; L71-V110 HydrophobicContact CD1-CG2 3.67Å
72	G	98.6	Very high	97.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.5	167.3	0	0	0	0	0	111.3	V108 L109 V110	G72-V108 PolarHBondContact N-O 3.46Å; G72-L109 WeakPolarHBondContact O-CA 3.4Å; G72-V110 PolarHBondContact O-N 3.05Å
73	I	98.7	Very high	97.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	117.4	170.6	-54.8	-52	0	0	0	108.3	Y55 A56 E59 L71 I79 V80 T81 V110	Y55-I73 HydrophobicContact CD2-CG2 4.26Å; A56-I73 HydrophobicContact CB-CD1 4.41Å; A56-I73 HydrophobicContact CB-CG1 3.98Å; E59-I73 HydrophobicContact CB-CD1 4.14Å; E59-I73 HydrophobicContact CG-CD1 3.63Å; L71-I73 HydrophobicContact CD1-CD1 4.27Å; L71-I73 HydrophobicContact CD2-CD1 4.19Å; L71-I73 HydrophobicContact CG-CD1 4.18Å; I73-I79 CarbonylContact O-C 3.47Å; I73-I79 WeakPolarHBondContact O-CA 3.41Å; I73-V80 HydrophobicContact CB-CG1 3.93Å; I73-V80 HydrophobicContact CG2-CG1 3.73Å; I73-V80 WeakPolarHBondContact O-CG1 3.41Å; I73-V80 PolarHBondContact O-N 2.62Å; I73-T81 HydrophobicContact CB-CG2 4.21Å; I73-T81 HydrophobicContact CG1-CG2 4.08Å; I73-T81 PolarHBondContact N-O 3.07Å; I73-V110 CarbonylContact C-O 3.56Å; I73-V110 WeakPolarHBondContact CA-O 3.48Å; I73-V110 HydrophobicContact CD1-CB 3.97Å; I73-V110 HydrophobicContact CD1-CG1 4.49Å
74	Q	98.3	Very high	97.7	Very high	45 Å²	45	45.8 Å²	45.8	21%	0.21	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.1	-175.5	-179.4	-179.9	1.4	0	0	110.8	K76 I78 V97 V110 G112	Q74-K76 WeakPolarHBondContact CG-O 3.37Å; Q74-K76 PolarHBondContact NE2-O 3.48Å; Q74-I78 WeakPolarHBondContact CA-O 3.5Å; Q74-V97 HydrophobicContact CG-CG2 3.77Å; Q74-V110 PolarHBondContact N-O 3Å; Q74-G112 PolarHBondContact O-N 3.42Å
75	Q	97	Very high	97.7	Very high	56 Å²	56	44.1 Å²	44.1	26%	0.262	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.5	164.6	-71.4	-177.7	-22.4	0	0	108.3	Y77 I78 V80 G112 E113	Q75-Y77 PolarHBondContact O-N 3.45Å; Q75-I78 PolarHBondContact N-O 3.08Å; Q75-I78 PolarHBondContact O-N 3.36Å; Q75-V80 HydrophobicContact CG-CB 4.25Å; Q75-V80 HydrophobicContact CG-CG1 4.04Å; Q75-G112 WeakPolarHBondContact CG-O 3.4Å; Q75-G112 PolarHBondContact NE2-O 2.95Å; Q75-E113 HydrophobicContact CB-CG 4.45Å; Q75-E113 HydrophobicContact CG-CG 4.41Å
76	K	94.8	Very high	97.7	Very high	70 Å²	70	40.6 Å²	40.6	30%	0.304	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	-106.5	-170.8	-51.3	-61.4	175	-168.5	0	111.4	Q74 E113 D320 S321	Q74-K76 WeakPolarHBondContact CG-O 3.37Å; Q74-K76 PolarHBondContact NE2-O 3.48Å; K76-E113 WeakPolarHBondContact CD-OE1 3.3Å; K76-E113 WeakPolarHBondContact CE-OE2 3.33Å; K76-E113 PolarHBondContact N-OE1 3.43Å; K76-E113 IonicContact NZ-OE1 2.7Å; K76-E113 IonicContact NZ-OE2 2.65Å; K76-E113 PolarHBondContact NZ-OE2 3.43Å; K76-D320 WeakPolarHBondContact CE-OD1 3.49Å; K76-D320 IonicContact NZ-OD1 2.71Å; K76-D320 PolarHBondContact NZ-OD1 3.05Å; K76-D320 IonicContact NZ-OD2 3.51Å; K76-S321 WeakPolarHBondContact CE-O 3.4Å
77	Y	94.8	Very high	97.7	Very high	133 Å²	133	41.9 Å²	41.9	52%	0.522	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	10.6	-175.6	-52.2	-72.1	0	0	0	113.2	Q75 V97 R323	Q75-Y77 PolarHBondContact O-N 3.45Å; Y77-V97 WeakPolarHBondContact O-CG2 3.45Å; Y77-V97 PolarHBondContact O-N 2.85Å; Y77-R323 HydrophobicContact CE2-CG 4.2Å; Y77-R323 VanDerWaalsContact CZ-NE 3.31Å; Y77-R323 PolarHBondContact OH-NE 3.39Å
78	I	97.1	Very high	97.7	Very high	81 Å²	81	42.3 Å²	42.3	42%	0.415	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.4	-173.3	-60.5	173.6	0	0	0	109.7	Q74 Q75 V80 L94	Q74-I78 WeakPolarHBondContact CA-O 3.5Å; Q75-I78 PolarHBondContact N-O 3.08Å; Q75-I78 PolarHBondContact O-N 3.36Å; I78-V80 PolarHBondContact O-N 3.41Å; I78-L94 HydrophobicContact CG2-CB 4.42Å; I78-L94 HydrophobicContact CG2-CD2 4.41Å
79	I	98.3	Very high	97.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	95.9	165.3	-54.3	-55.7	0	0	0	107.9	I73 T81 C82 V91 L94 M95 V97 A100 L109	I73-I79 CarbonylContact O-C 3.47Å; I73-I79 WeakPolarHBondContact O-CA 3.41Å; I79-T81 VanDerWaalsContact C-N 3.25Å; I79-T81 WeakPolarHBondContact CG2-O 3.43Å; I79-T81 PolarHBondContact O-N 3.29Å; I79-C82 HydrophobicContact CG2-CB 4.13Å; I79-V91 HydrophobicContact CG2-CG1 4.3Å; I79-L94 VanDerWaalsContact O-CA 3.3Å; I79-L94 WeakPolarHBondContact O-CA 3.14Å; I79-L94 PolarHBondContact O-N 3.22Å; I79-M95 PolarHBondContact N-O 3.5Å; I79-V97 HydrophobicContact CD1-CG2 3.82Å; I79-V97 HydrophobicContact CG1-CG2 4.46Å; I79-A100 HydrophobicContact CD1-CB 4.33Å; I79-A100 HydrophobicContact CG1-CB 3.63Å; I79-L109 HydrophobicContact CD1-CD2 3.44Å; I79-L109 VanDerWaalsContact CD1-CD2 3.44Å
80	V	97.8	Very high	97.7	Very high	31 Å²	31	39.1 Å²	39.1	19%	0.188	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	-36.7	-177.7	68.1	0	0	0	0	111.2	Y55 I73 Q75 I78	Y55-V80 HydrophobicContact CD2-CG1 3.86Å; Y55-V80 HydrophobicContact CE2-CG1 4.34Å; I73-V80 HydrophobicContact CB-CG1 3.93Å; I73-V80 HydrophobicContact CG2-CG1 3.73Å; I73-V80 WeakPolarHBondContact O-CG1 3.41Å; I73-V80 PolarHBondContact O-N 2.62Å; Q75-V80 HydrophobicContact CG-CB 4.25Å; Q75-V80 HydrophobicContact CG-CG1 4.04Å; I78-V80 PolarHBondContact O-N 3.41Å
81	T	98.5	Very high	97.7	Very high	15 Å²	15	38.9 Å²	38.9	9%	0.092	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	165.7	170.9	-163.9	0	0	0	0	110.2	A56 I73 I79	A56-T81 HydrophobicContact CB-CG2 4.39Å; I73-T81 HydrophobicContact CB-CG2 4.21Å; I73-T81 HydrophobicContact CG1-CG2 4.08Å; I73-T81 PolarHBondContact N-O 3.07Å; I79-T81 VanDerWaalsContact C-N 3.25Å; I79-T81 WeakPolarHBondContact CG2-O 3.43Å; I79-T81 PolarHBondContact O-N 3.29Å
82	C	98.6	Very high	97.6	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	154.1	178.7	59.4	0	0	0	0	110.5	C53 L71 I79 A86 R87 V91	C53-C82 WeakPolarHBondContact CB-O 3.33Å; L71-C82 CarbonylContact O-C 3.54Å; L71-C82 WeakPolarHBondContact O-CA 3.38Å; L71-C82 VanDerWaalsContact O-CB 3.26Å; L71-C82 WeakPolarHBondContact O-CB 3.4Å; I79-C82 HydrophobicContact CG2-CB 4.13Å; C82-A86 HydrophobicContact CB-CB 3.88Å; C82-R87 PolarHBondContact O-NE 3.31Å; C82-R87 WeakPolarHBondContact SG-CG 3.42Å; C82-V91 HydrophobicContact CB-CG1 4.14Å; C82-V91 PolarHBondContact SG-O 3.5Å
83	N	98.6	Very high	97.4	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	22%	0.215	C	C	.	.			trans	-70.4	164.7	175.3	73.6	-8.3	0	0	0	111.2	A56 M60 V69 L71 V85 A86 R87	A56-N83 HydrophobicContact CB-CB 4.15Å; M60-N83 HydrophobicContact CE-CB 4.02Å; M60-N83 HydrophobicContact SD-CB 3.9Å; V69-N83 PolarHBondContact O-ND2 3.36Å; L71-N83 HydrophobicContact CB-CB 4.31Å; L71-N83 PolarHBondContact N-OD1 3.26Å; L71-N83 PolarHBondContact O-N 2.92Å; L71-N83 PolarHBondContact O-OD1 3Å; N83-V85 PolarHBondContact O-N 2.94Å; N83-A86 PolarHBondContact O-N 3.09Å; N83-A86 VanDerWaalsContact O-N 3.08Å; N83-A86 WeakPolarHBondContact OD1-CB 3.45Å; N83-A86 PolarHBondContact OD1-N 3.39Å; N83-R87 WeakPolarHBondContact O-CG 3.29Å; N83-R87 PolarHBondContact O-N 2.65Å; N83-R87 VanDerWaalsContact O-N 3.07Å
84	Y	97.9	Very high	97.2	Very high	43 Å²	43	51.1 Å²	51.1	17%	0.169	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-30	-177	-74.8	-94.5	0	0	0	112.9	D52 C53 A86 R87 E88 P229	D52-Y84 HydrophobicContact CB-CE2 3.92Å; D52-Y84 PolarHBondContact OD1-OH 3.13Å; C53-Y84 HydrophobicContact CB-CE2 4.32Å; Y84-A86 VanDerWaalsContact C-N 3.29Å; Y84-A86 PolarHBondContact O-N 2.93Å; Y84-R87 VanDerWaalsContact CZ-NH1 3.27Å; Y84-R87 WeakPolarHBondContact O-CB 3.43Å; Y84-R87 PolarHBondContact O-N 3.27Å; Y84-R87 VanDerWaalsContact O-N 3.08Å; Y84-R87 PolarHBondContact OH-NH1 2.98Å; Y84-E88 WeakPolarHBondContact O-CG 3.31Å; Y84-E88 PolarHBondContact O-N 3.18Å; Y84-P229 HydrophobicContact CD1-CB 4.29Å; Y84-P229 HydrophobicContact CD1-CG 4.09Å; Y84-P229 HydrophobicContact CD2-CB 4.16Å; Y84-P229 HydrophobicContact CD2-CG 4.5Å; Y84-P229 HydrophobicContact CE1-CB 3.81Å; Y84-P229 HydrophobicContact CE1-CG 4.01Å; Y84-P229 HydrophobicContact CE2-CB 3.68Å; Y84-P229 HydrophobicContact CE2-CG 4.43Å; Y84-P229 HydrophobicContact CG-CB 4.44Å; Y84-P229 HydrophobicContact CG-CG 4.34Å; Y84-P229 VanDerWaalsContact CZ-CB 3.47Å
85	V	98.1	Very high	97.1	Very high	37 Å²	37	49.9 Å²	49.9	22%	0.224	24%	0.241	C	C	.	.	H	α-helix	trans	-59.4	-37.7	173.1	179.2	0	0	0	0	111.9	P70 N83 R89	P70-V85 HydrophobicContact CB-CG1 4.39Å; N83-V85 PolarHBondContact O-N 2.94Å; V85-R89 PolarHBondContact O-NH1 2.84Å
86	A	98.4	Very high	97.2	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-76.5	-34.9	172.2	0	0	0	0	0	112.9	P70 C82 N83 Y84 E88 R89 G90 V91 L107	P70-A86 HydrophobicContact CB-CB 3.86Å; C82-A86 HydrophobicContact CB-CB 3.88Å; N83-A86 PolarHBondContact O-N 3.09Å; N83-A86 VanDerWaalsContact O-N 3.08Å; N83-A86 WeakPolarHBondContact OD1-CB 3.45Å; N83-A86 PolarHBondContact OD1-N 3.39Å; Y84-A86 VanDerWaalsContact C-N 3.29Å; Y84-A86 PolarHBondContact O-N 2.93Å; A86-E88 VanDerWaalsContact C-N 3.33Å; A86-E88 PolarHBondContact O-N 3.15Å; A86-R89 CarbonylContact O-C 3.56Å; A86-R89 WeakPolarHBondContact O-CB 3.18Å; A86-R89 PolarHBondContact O-N 2.85Å; A86-R89 VanDerWaalsContact O-N 3.1Å; A86-G90 PolarHBondContact O-N 3.33Å; A86-V91 HydrophobicContact CB-CB 4.17Å; A86-V91 HydrophobicContact CB-CG2 4.39Å; A86-V91 WeakPolarHBondContact O-CB 3.37Å; A86-V91 PolarHBondContact O-N 3.36Å; A86-L107 HydrophobicContact CB-CD1 3.85Å
87	R	97.9	Very high	97.3	Very high	43 Å²	43	46.9 Å²	46.9	16%	0.162	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-36.9	177	-66	178.5	-173.1	-172.7	-0.8	112.9	C82 N83 Y84 R89 G90 V91	C82-R87 PolarHBondContact O-NE 3.31Å; C82-R87 WeakPolarHBondContact SG-CG 3.42Å; N83-R87 WeakPolarHBondContact O-CG 3.29Å; N83-R87 PolarHBondContact O-N 2.65Å; N83-R87 VanDerWaalsContact O-N 3.07Å; Y84-R87 VanDerWaalsContact CZ-NH1 3.27Å; Y84-R87 WeakPolarHBondContact O-CB 3.43Å; Y84-R87 PolarHBondContact O-N 3.27Å; Y84-R87 VanDerWaalsContact O-N 3.08Å; Y84-R87 PolarHBondContact OH-NH1 2.98Å; R87-R89 PolarHBondContact O-N 2.91Å; R87-G90 PolarHBondContact O-N 3.18Å; R87-V91 WeakPolarHBondContact CA-O 3.49Å
88	E	97.1	Very high	97.4	Very high	135 Å²	135	45.6 Å²	45.6	63%	0.631	24%	0.24	S	C	*	.	H	α-helix	trans	-60.3	-28.8	174.1	-75	170.5	-171.3	0	0	112.4	Y84 A86 G90	Y84-E88 WeakPolarHBondContact O-CG 3.31Å; Y84-E88 PolarHBondContact O-N 3.18Å; A86-E88 VanDerWaalsContact C-N 3.33Å; A86-E88 PolarHBondContact O-N 3.15Å; E88-G90 VanDerWaalsContact C-N 3.29Å
89	R	97.3	Very high	97.5	Very high	94 Å²	94	44.4 Å²	44.4	36%	0.355	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	10.1	174.6	-59.9	178.5	172.3	84.4	-10.4	113.6	V85 A86 R87 C104 E106	V85-R89 PolarHBondContact O-NH1 2.84Å; A86-R89 CarbonylContact O-C 3.56Å; A86-R89 WeakPolarHBondContact O-CB 3.18Å; A86-R89 PolarHBondContact O-N 2.85Å; A86-R89 VanDerWaalsContact O-N 3.1Å; R87-R89 PolarHBondContact O-N 2.91Å; R89-C104 HydrophobicContact CB-CB 4.22Å; R89-C104 WeakPolarHBondContact CD-SG 3.09Å; R89-E106 WeakPolarHBondContact CD-OE1 3.29Å; R89-E106 IonicContact CZ-OE1 3.97Å; R89-E106 IonicContact NE-OE1 3.19Å; R89-E106 PolarHBondContact NE-OE1 3.04Å; R89-E106 IonicContact NH2-OE1 3.67Å
90	G	96.9	Very high	97.5	Very high	30 Å²	30	44.4 Å²	44.4	31%	0.309	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	7.3	175.4	0	0	0	0	0	115.6	A86 R87 E88 K103	A86-G90 PolarHBondContact O-N 3.33Å; R87-G90 PolarHBondContact O-N 3.18Å; E88-G90 VanDerWaalsContact C-N 3.29Å; G90-K103 VanDerWaalsContact O-CD 3.29Å; G90-K103 WeakPolarHBondContact O-CD 3.26Å
91	V	97.9	Very high	97.5	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	24%	0.241	C	C	.	.			trans	-74.9	125.8	170.7	-176.2	0	0	0	0	109.1	I79 C82 A86 R87 M95 A100 C104 L107	I79-V91 HydrophobicContact CG2-CG1 4.3Å; C82-V91 HydrophobicContact CB-CG1 4.14Å; C82-V91 PolarHBondContact SG-O 3.5Å; A86-V91 HydrophobicContact CB-CB 4.17Å; A86-V91 HydrophobicContact CB-CG2 4.39Å; A86-V91 WeakPolarHBondContact O-CB 3.37Å; A86-V91 PolarHBondContact O-N 3.36Å; R87-V91 WeakPolarHBondContact CA-O 3.49Å; V91-M95 HydrophobicContact CG1-SD 4.34Å; V91-A100 HydrophobicContact CG1-CB 3.94Å; V91-C104 HydrophobicContact CG2-CB 3.77Å; V91-L107 HydrophobicContact CG1-CD2 4.36Å; V91-L107 HydrophobicContact CG2-CD1 4.39Å; V91-L107 HydrophobicContact CG2-CD2 4.29Å
92	T	96.1	Very high	97.4	Very high	45 Å²	45	53 Å²	53	28%	0.276	27%	0.27	S	S	.	.			trans	-113.3	166.4	-179.5	66.7	0	0	0	0	112.2	M95	T92-M95 HydrophobicContact CG2-CE 4.25Å; T92-M95 WeakPolarHBondContact O-CB 3.08Å; T92-M95 WeakPolarHBondContact OG1-CE 3.32Å
93	K	94.9	Very high	97.4	Very high	85 Å²	85	58.5 Å²	58.5	37%	0.37	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	144.6	171.9	-69	173.1	-79.1	167.8	0	109.6	E12 M95	E12-K93 WeakPolarHBondContact OE2-CE 3.47Å; E12-K93 IonicContact OE2-NZ 3.15Å; E12-K93 PolarHBondContact OE2-NZ 3.12Å; K93-M95 PolarHBondContact O-N 3.28Å
94	L	95.7	Very high	97.4	Very high	127 Å²	127	58.3 Å²	58.3	67%	0.665	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	14.1	178.6	-49.8	-180	0	0	0	115.3	I78 I79	I78-L94 HydrophobicContact CG2-CB 4.42Å; I78-L94 HydrophobicContact CG2-CD2 4.41Å; I79-L94 VanDerWaalsContact O-CA 3.3Å; I79-L94 WeakPolarHBondContact O-CA 3.14Å; I79-L94 PolarHBondContact O-N 3.22Å
95	M	96.2	Very high	97.4	Very high	18 Å²	18	60.8 Å²	60.8	9%	0.089	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	148.9	173.7	-173.9	175.1	-78.7	0	0	111.4	I79 V91 T92 K93 D99 A100 K103	I79-M95 PolarHBondContact N-O 3.5Å; V91-M95 HydrophobicContact CG1-SD 4.34Å; T92-M95 HydrophobicContact CG2-CE 4.25Å; T92-M95 WeakPolarHBondContact O-CB 3.08Å; T92-M95 WeakPolarHBondContact OG1-CE 3.32Å; K93-M95 PolarHBondContact O-N 3.28Å; M95-D99 HydrophobicContact CG-CB 3.93Å; M95-D99 HydrophobicContact SD-CB 4.24Å; M95-A100 HydrophobicContact CG-CB 4.13Å; M95-A100 WeakPolarHBondContact SD-CA 3.31Å; M95-A100 HydrophobicContact SD-CB 3.76Å; M95-K103 HydrophobicContact CE-CD 3.76Å; M95-K103 VanDerWaalsContact CE-NZ 3.25Å; M95-K103 HydrophobicContact SD-CD 4.04Å
96	S	97.7	Very high	97.3	Very high	38 Å²	38	63.8 Å²	63.8	27%	0.266	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	149.7	172.1	88.2	0	0	0	0	110.8	T98 D99 A100	S96-T98 PolarHBondContact O-N 3.29Å; S96-D99 WeakPolarHBondContact CB-OD2 3.46Å; S96-D99 PolarHBondContact O-N 3.33Å; S96-D99 PolarHBondContact OG-N 3.2Å; S96-D99 VanDerWaalsContact OG-N 3.09Å; S96-D99 PolarHBondContact OG-OD1 3.4Å; S96-D99 PolarHBondContact OG-OD2 3.31Å; S96-A100 VanDerWaalsContact O-CB 3.3Å; S96-A100 WeakPolarHBondContact O-CB 3.39Å; S96-A100 PolarHBondContact O-N 3.44Å
97	V	97.4	Very high	97.4	Very high	26 Å²	26	64 Å²	64	16%	0.158	33%	0.327	C	S	.	.	H	α-helix	trans	-60	-35.5	176.9	170.2	0	0	0	0	111.2	Q74 Y77 I79 K101 L109	Q74-V97 HydrophobicContact CG-CG2 3.77Å; Y77-V97 WeakPolarHBondContact O-CG2 3.45Å; Y77-V97 PolarHBondContact O-N 2.85Å; I79-V97 HydrophobicContact CD1-CG2 3.82Å; I79-V97 HydrophobicContact CG1-CG2 4.46Å; V97-K101 WeakPolarHBondContact O-CB 3.37Å; V97-K101 WeakPolarHBondContact O-CG 3.46Å; V97-K101 PolarHBondContact O-N 3.29Å; V97-L109 HydrophobicContact CG1-CD1 3.79Å
98	T	97.6	Very high	97.4	Very high	105 Å²	105	64.4 Å²	64.4	64%	0.644	33%	0.334	S	S	*	.	H	α-helix	trans	-62.7	-54.5	178.2	-52.7	0	0	0	0	110.8	S96 A100 K101 E102	S96-T98 PolarHBondContact O-N 3.29Å; T98-A100 VanDerWaalsContact C-N 3.29Å; T98-A100 PolarHBondContact O-N 2.72Å; T98-K101 PolarHBondContact O-N 3.39Å; T98-K101 VanDerWaalsContact O-N 3.15Å; T98-E102 PolarHBondContact O-N 3.48Å
99	D	98	Very high	97.5	Very high	57 Å²	57	60.5 Å²	60.5	31%	0.305	32%	0.317	S	S	.	.	H	α-helix	trans	-66.1	-35.7	-177.6	-47.2	-30.9	0	0	0	111.3	M95 S96 K101 E102 K103	M95-D99 HydrophobicContact CG-CB 3.93Å; M95-D99 HydrophobicContact SD-CB 4.24Å; S96-D99 WeakPolarHBondContact CB-OD2 3.46Å; S96-D99 PolarHBondContact O-N 3.33Å; S96-D99 PolarHBondContact OG-N 3.2Å; S96-D99 VanDerWaalsContact OG-N 3.09Å; S96-D99 PolarHBondContact OG-OD1 3.4Å; S96-D99 PolarHBondContact OG-OD2 3.31Å; D99-K101 VanDerWaalsContact C-N 3.31Å; D99-K101 PolarHBondContact O-N 3.11Å; D99-E102 PolarHBondContact O-N 3.12Å; D99-K103 WeakPolarHBondContact O-CG 3.28Å; D99-K103 PolarHBondContact O-N 3.36Å
100	A	98	Very high	97.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-39.5	176.6	0	0	0	0	0	111.8	I79 V91 M95 S96 T98 C104 L107	I79-A100 HydrophobicContact CD1-CB 4.33Å; I79-A100 HydrophobicContact CG1-CB 3.63Å; V91-A100 HydrophobicContact CG1-CB 3.94Å; M95-A100 HydrophobicContact CG-CB 4.13Å; M95-A100 WeakPolarHBondContact SD-CA 3.31Å; M95-A100 HydrophobicContact SD-CB 3.76Å; S96-A100 VanDerWaalsContact O-CB 3.3Å; S96-A100 WeakPolarHBondContact O-CB 3.39Å; S96-A100 PolarHBondContact O-N 3.44Å; T98-A100 VanDerWaalsContact C-N 3.29Å; T98-A100 PolarHBondContact O-N 2.72Å; A100-C104 PolarHBondContact O-N 3.18Å; A100-L107 HydrophobicContact CB-CD2 3.73Å
101	K	97.8	Very high	97.6	Very high	77 Å²	77	64 Å²	64	34%	0.335	33%	0.329	S	S	.	.	H	α-helix	trans	-73.4	-30.4	176.4	-83.6	-77.2	174.1	179.9	0	113	V97 T98 D99 C104 P105 L107	V97-K101 WeakPolarHBondContact O-CB 3.37Å; V97-K101 WeakPolarHBondContact O-CG 3.46Å; V97-K101 PolarHBondContact O-N 3.29Å; T98-K101 PolarHBondContact O-N 3.39Å; T98-K101 VanDerWaalsContact O-N 3.15Å; D99-K101 VanDerWaalsContact C-N 3.31Å; D99-K101 PolarHBondContact O-N 3.11Å; K101-C104 CarbonylContact O-C 3.6Å; K101-C104 VanDerWaalsContact O-C 3.29Å; K101-P105 PolarHBondContact NZ-O 2.93Å; K101-P105 VanDerWaalsContact O-CA 3.24Å; K101-P105 WeakPolarHBondContact O-CA 3.18Å; K101-P105 VanDerWaalsContact O-N 3.15Å; K101-L107 HydrophobicContact CD-CB 4.49Å; K101-L107 WeakPolarHBondContact CE-O 3.32Å; K101-L107 PolarHBondContact NZ-O 3.13Å
102	E	97.9	Very high	97.6	Very high	149 Å²	149	64 Å²	64	70%	0.696	33%	0.329	S	S	*	.	H	α-helix	trans	-66.4	-46	171.5	-173.5	177.6	174.9	0	0	111.2	T98 D99	T98-E102 PolarHBondContact O-N 3.48Å; D99-E102 PolarHBondContact O-N 3.12Å
103	K	97.7	Very high	97.5	Very high	115 Å²	115	66.1 Å²	66.1	50%	0.5	34%	0.336	S	S	.	.	H	α-helix	trans	-69.3	-34.1	177.6	-68.8	-176	-175.4	-170.5	0	113.5	G90 M95 D99	G90-K103 VanDerWaalsContact O-CD 3.29Å; G90-K103 WeakPolarHBondContact O-CD 3.26Å; M95-K103 HydrophobicContact CE-CD 3.76Å; M95-K103 VanDerWaalsContact CE-NZ 3.25Å; M95-K103 HydrophobicContact SD-CD 4.04Å; D99-K103 WeakPolarHBondContact O-CG 3.28Å; D99-K103 PolarHBondContact O-N 3.36Å
104	C	98.1	Very high	97.5	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.344	C	S	.	.			trans	-139.2	87.8	-179.4	-179.6	0	0	0	0	110	R89 V91 A100 K101 E106 L107	R89-C104 HydrophobicContact CB-CB 4.22Å; R89-C104 WeakPolarHBondContact CD-SG 3.09Å; V91-C104 HydrophobicContact CG2-CB 3.77Å; A100-C104 PolarHBondContact O-N 3.18Å; K101-C104 CarbonylContact O-C 3.6Å; K101-C104 VanDerWaalsContact O-C 3.29Å; C104-E106 PolarHBondContact O-N 3.33Å; C104-E106 PolarHBondContact SG-OE2 2.65Å; C104-L107 HydrophobicContact CB-CB 4.09Å; C104-L107 WeakPolarHBondContact O-CB 3.24Å; C104-L107 PolarHBondContact O-N 3.27Å; C104-L107 PolarHBondContact SG-N 3.24Å
105	P	98.1	Very high	97.5	Very high	94 Å²	94	63.1 Å²	63.1	61%	0.61	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-36.6	-179.8	-28.5	37	0	0	0	113.3	K101 L107	K101-P105 PolarHBondContact NZ-O 2.93Å; K101-P105 VanDerWaalsContact O-CA 3.24Å; K101-P105 WeakPolarHBondContact O-CA 3.18Å; K101-P105 VanDerWaalsContact O-N 3.15Å; P105-L107 VanDerWaalsContact C-N 3.25Å; P105-L107 PolarHBondContact O-N 2.96Å
106	E	97.8	Very high	97.4	Very high	101 Å²	101	64.1 Å²	64.1	47%	0.472	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.4	179.4	79.2	-80.8	-155	0	0	114.5	P70 R89 C104 V108	P70-E106 HydrophobicContact CG-CG 3.74Å; R89-E106 WeakPolarHBondContact CD-OE1 3.29Å; R89-E106 IonicContact CZ-OE1 3.97Å; R89-E106 IonicContact NE-OE1 3.19Å; R89-E106 PolarHBondContact NE-OE1 3.04Å; R89-E106 IonicContact NH2-OE1 3.67Å; C104-E106 PolarHBondContact O-N 3.33Å; C104-E106 PolarHBondContact SG-OE2 2.65Å; E106-V108 PolarHBondContact O-N 3.01Å
107	L	98.6	Very high	97.4	Very high	3 Å²	3	65.4 Å²	65.4	2%	0.016	33%	0.333	C	S	.	.			trans	-54.3	121.2	-179.5	-177.6	66.4	0	0	0	111.7	P70 A86 V91 A100 K101 C104 P105 L109	P70-L107 HydrophobicContact CB-CD1 4.05Å; A86-L107 HydrophobicContact CB-CD1 3.85Å; V91-L107 HydrophobicContact CG1-CD2 4.36Å; V91-L107 HydrophobicContact CG2-CD1 4.39Å; V91-L107 HydrophobicContact CG2-CD2 4.29Å; A100-L107 HydrophobicContact CB-CD2 3.73Å; K101-L107 HydrophobicContact CD-CB 4.49Å; K101-L107 WeakPolarHBondContact CE-O 3.32Å; K101-L107 PolarHBondContact NZ-O 3.13Å; C104-L107 HydrophobicContact CB-CB 4.09Å; C104-L107 WeakPolarHBondContact O-CB 3.24Å; C104-L107 PolarHBondContact O-N 3.27Å; C104-L107 PolarHBondContact SG-N 3.24Å; P105-L107 VanDerWaalsContact C-N 3.25Å; P105-L107 PolarHBondContact O-N 2.96Å; L107-L109 HydrophobicContact CD2-CD2 3.73Å; L107-L109 HydrophobicContact CG-CD2 3.89Å
108	V	98.6	Very high	97.4	Very high	53 Å²	53	64.3 Å²	64.3	32%	0.321	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	132	172.9	-178	0	0	0	0	108.7	L66 V69 P70 L71 G72 E106	L66-V108 HydrophobicContact CD2-CG1 3.95Å; V69-V108 HydrophobicContact CB-CG2 4.28Å; V69-V108 HydrophobicContact CG2-CB 4.37Å; V69-V108 HydrophobicContact CG2-CG2 3.94Å; P70-V108 PolarHBondContact O-N 3.31Å; L71-V108 WeakPolarHBondContact CA-O 3.43Å; L71-V108 HydrophobicContact CD1-CG1 4.45Å; G72-V108 PolarHBondContact N-O 3.46Å; E106-V108 PolarHBondContact O-N 3.01Å
109	L	98.6	Very high	97.4	Very high	52 Å²	52	61.6 Å²	61.6	27%	0.272	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.8	-179.6	-62.9	179.3	0	0	0	111	G72 I79 V97 L107	G72-L109 WeakPolarHBondContact O-CA 3.4Å; I79-L109 HydrophobicContact CD1-CD2 3.44Å; I79-L109 VanDerWaalsContact CD1-CD2 3.44Å; V97-L109 HydrophobicContact CG1-CD1 3.79Å; L107-L109 HydrophobicContact CD2-CD2 3.73Å; L107-L109 HydrophobicContact CG-CD2 3.89Å
110	V	98.6	Very high	97.3	Very high	31 Å²	31	63.3 Å²	63.3	19%	0.188	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.3	170.7	175.6	0	0	0	0	108.9	E59 L66 L71 G72 I73 Q74 G112	E59-V110 HydrophobicContact CG-CB 4.41Å; E59-V110 HydrophobicContact CG-CG1 3.83Å; L66-V110 HydrophobicContact CD1-CG2 3.89Å; L71-V110 HydrophobicContact CD1-CB 4.22Å; L71-V110 HydrophobicContact CD1-CG2 3.67Å; G72-V110 PolarHBondContact O-N 3.05Å; I73-V110 CarbonylContact C-O 3.56Å; I73-V110 WeakPolarHBondContact CA-O 3.48Å; I73-V110 HydrophobicContact CD1-CB 3.97Å; I73-V110 HydrophobicContact CD1-CG1 4.49Å; Q74-V110 PolarHBondContact N-O 3Å; V110-G112 PolarHBondContact O-N 3.31Å
111	K	98.3	Very high	97.3	Very high	167 Å²	167	64.6 Å²	64.6	73%	0.726	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.6	176.7	-65.9	-174.7	179	-178.7	0	109.9
112	G	97.3	Very high	97.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.301	C	S	.	.			trans	-114.6	25.3	179.1	0	0	0	0	0	114	Q74 Q75 V110 L115	Q74-G112 PolarHBondContact O-N 3.42Å; Q75-G112 WeakPolarHBondContact CG-O 3.4Å; Q75-G112 PolarHBondContact NE2-O 2.95Å; V110-G112 PolarHBondContact O-N 3.31Å; G112-L115 WeakPolarHBondContact O-CD2 3.34Å
113	E	95.3	Very high	97.3	Very high	90 Å²	90	57.1 Å²	57.1	42%	0.421	28%	0.28	S	S	.	.			trans	-72.5	-34	179	-65.5	179.3	-159.8	0	0	112.1	Q75 K76 L115	Q75-E113 HydrophobicContact CB-CG 4.45Å; Q75-E113 HydrophobicContact CG-CG 4.41Å; K76-E113 WeakPolarHBondContact CD-OE1 3.3Å; K76-E113 WeakPolarHBondContact CE-OE2 3.33Å; K76-E113 PolarHBondContact N-OE1 3.43Å; K76-E113 IonicContact NZ-OE1 2.7Å; K76-E113 IonicContact NZ-OE2 2.65Å; K76-E113 PolarHBondContact NZ-OE2 3.43Å; E113-L115 PolarHBondContact O-N 2.8Å
114	D	94.6	Very high	97.3	Very high	101 Å²	101	55.7 Å²	55.7	54%	0.54	28%	0.276	S	S	.	.			trans	-79.6	109.7	169.6	-177	-0.1	0	0	0	109.9	T116	D114-T116 VanDerWaalsContact C-N 3.3Å; D114-T116 PolarHBondContact O-N 2.74Å; D114-T116 WeakPolarHBondContact OD1-CB 3.43Å; D114-T116 PolarHBondContact OD1-N 3.07Å; D114-T116 PolarHBondContact OD1-OG1 2.98Å
115	L	96.3	Very high	97.3	Very high	48 Å²	48	55.7 Å²	55.7	25%	0.251	28%	0.276	S	S	.	.			trans	-86.5	4	-176.9	-58.3	-176.3	0	0	0	113.9	Y55 G112 E113 Y118 R119 F141	Y55-L115 HydrophobicContact CE2-CD2 3.86Å; G112-L115 WeakPolarHBondContact O-CD2 3.34Å; E113-L115 PolarHBondContact O-N 2.8Å; L115-Y118 HydrophobicContact CD2-CD2 3.82Å; L115-Y118 HydrophobicContact CD2-CE2 4.27Å; L115-Y118 PolarHBondContact O-N 2.94Å; L115-R119 VanDerWaalsContact O-CB 3.26Å; L115-R119 WeakPolarHBondContact O-CB 3.45Å; L115-R119 PolarHBondContact O-N 2.92Å; L115-R119 PolarHBondContact O-NH1 3.03Å; L115-F141 HydrophobicContact CB-CE2 4.23Å; L115-F141 HydrophobicContact CD1-CE2 4.41Å
116	T	94.3	Very high	97.3	Very high	40 Å²	40	51.8 Å²	51.8	25%	0.245	25%	0.25	C	S	.	.	H	α-helix	trans	-57.5	-54.9	-171.2	-61.3	0	0	0	0	112.2	D114 Y118 R119 E120	D114-T116 VanDerWaalsContact C-N 3.3Å; D114-T116 PolarHBondContact O-N 2.74Å; D114-T116 WeakPolarHBondContact OD1-CB 3.43Å; D114-T116 PolarHBondContact OD1-N 3.07Å; D114-T116 PolarHBondContact OD1-OG1 2.98Å; T116-Y118 PolarHBondContact O-N 2.84Å; T116-R119 WeakPolarHBondContact O-CB 3.3Å; T116-R119 PolarHBondContact O-N 3.36Å; T116-E120 WeakPolarHBondContact O-CG 3.44Å; T116-E120 PolarHBondContact O-N 2.98Å
117	H	96.5	Very high	97.3	Very high	65 Å²	65	53 Å²	53	30%	0.301	26%	0.256	S	S	.	.	H	α-helix	trans	-69.5	-33.2	-177.8	-57.1	-52.5	0	0	0	113.4	V58 R62 R119 E120 M121	V58-H117 HydrophobicContact CG1-CB 4.35Å; R62-H117 PolarHBondContact NH1-CD2 3.03Å; R62-H117 VanDerWaalsContact NH1-CD2 3.3Å; R62-H117 PolarHBondContact NH2-CD2 3.43Å; R62-H117 PolarHBondContact NH2-NE2 3.06Å; H117-R119 VanDerWaalsContact C-N 3.33Å; H117-E120 IonicContact ND1-OE2 2.95Å; H117-E120 PolarHBondContact ND1-OE2 3.5Å; H117-M121 VanDerWaalsContact O-CB 3.32Å; H117-M121 WeakPolarHBondContact O-CB 3.48Å; H117-M121 PolarHBondContact O-N 2.97Å
118	Y	98.3	Very high	97.3	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-65.6	-39.6	174	-48.4	-43.3	0	0	0	111	F54 Y55 V58 E59 L115 T116 S122	F54-Y118 WeakPolarHBondContact CE1-O 3.48Å; F54-Y118 VanDerWaalsContact CZ-O 3.24Å; F54-Y118 WeakPolarHBondContact CZ-O 3.26Å; Y55-Y118 AromaticContact CD1-CD1 3.81Å; Y55-Y118 HydrophobicContact CD1-CD1 3.81Å; Y55-Y118 AromaticContact CD1-CD2 3.78Å; Y55-Y118 HydrophobicContact CD1-CD2 3.78Å; Y55-Y118 HydrophobicContact CD1-CE1 4.41Å; Y55-Y118 HydrophobicContact CD1-CE2 4.37Å; Y55-Y118 AromaticContact CD1-CG 3.5Å; Y55-Y118 HydrophobicContact CD1-CG 3.5Å; Y55-Y118 VanDerWaalsContact CD1-CG 3.5Å; Y55-Y118 AromaticContact CD2-CD2 3.73Å; Y55-Y118 HydrophobicContact CD2-CD2 3.73Å; Y55-Y118 AromaticContact CD2-CE2 3.7Å; Y55-Y118 HydrophobicContact CD2-CE2 3.7Å; Y55-Y118 HydrophobicContact CD2-CG 4.29Å; Y55-Y118 HydrophobicContact CE1-CD1 4.49Å; Y55-Y118 AromaticContact CE1-CD2 3.86Å; Y55-Y118 HydrophobicContact CE1-CD2 3.86Å; Y55-Y118 AromaticContact CE1-CG 3.74Å; Y55-Y118 HydrophobicContact CE1-CG 3.74Å; Y55-Y118 AromaticContact CE2-CD2 3.78Å; Y55-Y118 HydrophobicContact CE2-CD2 3.78Å; Y55-Y118 HydrophobicContact CE2-CE2 4.09Å; Y55-Y118 HydrophobicContact CE2-CG 4.47Å; Y55-Y118 AromaticContact CG-CD1 3.96Å; Y55-Y118 HydrophobicContact CG-CD1 3.96Å; Y55-Y118 AromaticContact CG-CD2 3.74Å; Y55-Y118 HydrophobicContact CG-CD2 3.74Å; Y55-Y118 HydrophobicContact CG-CE1 4.1Å; Y55-Y118 AromaticContact CG-CE2 3.87Å; Y55-Y118 HydrophobicContact CG-CE2 3.87Å; Y55-Y118 AromaticContact CG-CG 3.82Å; Y55-Y118 HydrophobicContact CG-CG 3.82Å; Y55-Y118 AromaticContact CZ-CD2 3.85Å; V58-Y118 HydrophobicContact CB-CD1 3.72Å; V58-Y118 HydrophobicContact CB-CE1 3.94Å; V58-Y118 HydrophobicContact CG1-CD1 3.69Å; V58-Y118 HydrophobicContact CG1-CE1 3.91Å; V58-Y118 HydrophobicContact CG2-CD1 4.09Å; E59-Y118 HydrophobicContact CG-CE1 4.25Å; E59-Y118 VanDerWaalsContact OE1-CE1 3.28Å; E59-Y118 WeakPolarHBondContact OE1-CE1 3.44Å; E59-Y118 PolarHBondContact OE1-OH 3.09Å; L115-Y118 HydrophobicContact CD2-CD2 3.82Å; L115-Y118 HydrophobicContact CD2-CE2 4.27Å; L115-Y118 PolarHBondContact O-N 2.94Å; T116-Y118 PolarHBondContact O-N 2.84Å; Y118-S122 WeakPolarHBondContact O-CB 3.31Å; Y118-S122 PolarHBondContact O-N 3.32Å
119	R	96.7	Very high	97.3	Very high	49 Å²	49	51.1 Å²	51.1	19%	0.185	24%	0.244	C	C	.	.	H	α-helix	trans	-66.8	-47.1	176.4	-175.5	-175.9	-58.4	96.4	5.7	111.5	L115 T116 H117 S122 Y123 F141 R345	L115-R119 VanDerWaalsContact O-CB 3.26Å; L115-R119 WeakPolarHBondContact O-CB 3.45Å; L115-R119 PolarHBondContact O-N 2.92Å; L115-R119 PolarHBondContact O-NH1 3.03Å; T116-R119 WeakPolarHBondContact O-CB 3.3Å; T116-R119 PolarHBondContact O-N 3.36Å; H117-R119 VanDerWaalsContact C-N 3.33Å; R119-S122 WeakPolarHBondContact O-CB 3.47Å; R119-S122 PolarHBondContact O-N 3.05Å; R119-Y123 HydrophobicContact CG-CD2 3.86Å; R119-Y123 HydrophobicContact CG-CE2 3.59Å; R119-Y123 WeakPolarHBondContact O-CD2 3.42Å; R119-Y123 PolarHBondContact O-N 3.36Å; R119-F141 HydrophobicContact CB-CE2 4.04Å; R119-F141 HydrophobicContact CB-CZ 4.06Å; R119-F141 HydrophobicContact CG-CZ 4.23Å; R119-R345 VanDerWaalsContact CZ-NH1 3.32Å
120	E	96.2	Very high	97.2	Very high	93 Å²	93	52.3 Å²	52.3	44%	0.435	25%	0.25	S	S	.	.	H	α-helix	trans	-57.6	-51.5	177.5	-73	167.9	169.2	0	0	111.2	T116 H117 S122 Y123 Q124	T116-E120 WeakPolarHBondContact O-CG 3.44Å; T116-E120 PolarHBondContact O-N 2.98Å; H117-E120 IonicContact ND1-OE2 2.95Å; H117-E120 PolarHBondContact ND1-OE2 3.5Å; E120-S122 VanDerWaalsContact C-N 3.29Å; E120-S122 PolarHBondContact O-N 2.93Å; E120-Y123 PolarHBondContact O-N 3.02Å; E120-Y123 VanDerWaalsContact O-N 3.14Å; E120-Q124 WeakPolarHBondContact O-CG 3.3Å; E120-Q124 PolarHBondContact O-N 3.25Å
121	M	98.5	Very high	97.1	Very high	26 Å²	26	54.8 Å²	54.8	13%	0.128	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-39.8	177.9	-175.5	59.8	68.9	0	0	111.8	F54 V58 H117 Y123 Q124 V125 L205 L207	F54-M121 HydrophobicContact CE2-CB 4.4Å; F54-M121 HydrophobicContact CE2-CG 3.97Å; F54-M121 HydrophobicContact CZ-CB 4.17Å; F54-M121 HydrophobicContact CZ-CG 4.24Å; V58-M121 HydrophobicContact CG2-CB 4.06Å; V58-M121 HydrophobicContact CG2-CG 3.91Å; H117-M121 VanDerWaalsContact O-CB 3.32Å; H117-M121 WeakPolarHBondContact O-CB 3.48Å; H117-M121 PolarHBondContact O-N 2.97Å; M121-Y123 VanDerWaalsContact C-N 3.33Å; M121-Y123 PolarHBondContact O-N 3.49Å; M121-Q124 PolarHBondContact O-N 3.03Å; M121-V125 WeakPolarHBondContact O-CG2 3.36Å; M121-V125 PolarHBondContact O-N 3.47Å; M121-L205 HydrophobicContact SD-CB 4.13Å; M121-L207 HydrophobicContact CG-CD1 3.62Å; M121-L207 HydrophobicContact CG-CD2 4.32Å; M121-L207 HydrophobicContact CG-CG 4.36Å; M121-L207 HydrophobicContact SD-CD1 3.61Å; M121-L207 HydrophobicContact SD-CG 4.2Å
122	S	98.3	Very high	97.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-41.5	175.5	177.4	0	0	0	0	112.6	Y118 R119 E120 V125 T126 R138 F141	Y118-S122 WeakPolarHBondContact O-CB 3.31Å; Y118-S122 PolarHBondContact O-N 3.32Å; R119-S122 WeakPolarHBondContact O-CB 3.47Å; R119-S122 PolarHBondContact O-N 3.05Å; E120-S122 VanDerWaalsContact C-N 3.29Å; E120-S122 PolarHBondContact O-N 2.93Å; S122-V125 PolarHBondContact O-N 3.44Å; S122-T126 PolarHBondContact O-N 2.85Å; S122-T126 PolarHBondContact O-OG1 3.26Å; S122-R138 VanDerWaalsContact C-NH1 3.34Å; S122-R138 PolarHBondContact O-NH1 3.03Å; S122-R138 VanDerWaalsContact OG-CZ 3.27Å; S122-R138 PolarHBondContact OG-NH1 3.38Å; S122-R138 PolarHBondContact OG-NH2 3.45Å; S122-F141 WeakPolarHBondContact CB-O 3.3Å; S122-F141 VanDerWaalsContact OG-C 3.3Å; S122-F141 WeakPolarHBondContact OG-CA 3.36Å; S122-F141 PolarHBondContact OG-O 2.96Å
123	Y	96.8	Very high	96.9	Very high	69 Å²	69	50.5 Å²	50.5	27%	0.271	25%	0.252	S	S	.	.	H	α-helix	trans	-67.4	-40.6	175.4	-81.7	-69.6	0	0	0	111.9	R119 E120 M121 V125 T126 E127 P313	R119-Y123 HydrophobicContact CG-CD2 3.86Å; R119-Y123 HydrophobicContact CG-CE2 3.59Å; R119-Y123 WeakPolarHBondContact O-CD2 3.42Å; R119-Y123 PolarHBondContact O-N 3.36Å; E120-Y123 PolarHBondContact O-N 3.02Å; E120-Y123 VanDerWaalsContact O-N 3.14Å; M121-Y123 VanDerWaalsContact C-N 3.33Å; M121-Y123 PolarHBondContact O-N 3.49Å; Y123-V125 VanDerWaalsContact C-N 3.28Å; Y123-V125 PolarHBondContact O-N 3.13Å; Y123-T126 PolarHBondContact O-N 3.38Å; Y123-T126 VanDerWaalsContact O-N 3.15Å; Y123-E127 WeakPolarHBondContact O-CB 3.48Å; Y123-E127 WeakPolarHBondContact O-CG 3.39Å; Y123-E127 PolarHBondContact O-N 2.88Å; Y123-P313 WeakPolarHBondContact OH-CD 3.31Å; Y123-P313 VanDerWaalsContact OH-CG 3.24Å; Y123-P313 WeakPolarHBondContact OH-CG 3.38Å
124	Q	98.1	Very high	97	Very high	85 Å²	85	50.9 Å²	50.9	40%	0.397	26%	0.262	S	S	.	.	H	α-helix	trans	-58.9	-38.8	175.4	-68.9	175.3	7.2	0	0	112.3	E120 M121 L128 L205	E120-Q124 WeakPolarHBondContact O-CG 3.3Å; E120-Q124 PolarHBondContact O-N 3.25Å; M121-Q124 PolarHBondContact O-N 3.03Å; Q124-L128 VanDerWaalsContact O-CB 3.32Å; Q124-L128 WeakPolarHBondContact O-CB 3.47Å; Q124-L128 PolarHBondContact O-N 2.88Å; Q124-L205 HydrophobicContact CB-CD1 4.25Å; Q124-L205 HydrophobicContact CB-CD2 4.05Å
125	V	98.4	Very high	97.1	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-48.5	174.2	173	0	0	0	0	111	L51 M121 S122 Y123 E127 L128 L129 I201 L205 L207	L51-V125 HydrophobicContact CD1-CG1 4.41Å; L51-V125 HydrophobicContact CD1-CG2 3.99Å; M121-V125 WeakPolarHBondContact O-CG2 3.36Å; M121-V125 PolarHBondContact O-N 3.47Å; S122-V125 PolarHBondContact O-N 3.44Å; Y123-V125 VanDerWaalsContact C-N 3.28Å; Y123-V125 PolarHBondContact O-N 3.13Å; V125-E127 PolarHBondContact O-N 2.73Å; V125-L128 PolarHBondContact O-N 3.25Å; V125-L129 HydrophobicContact CG1-CD1 4.26Å; V125-L129 WeakPolarHBondContact O-CG 3.49Å; V125-L129 PolarHBondContact O-N 3.45Å; V125-I201 HydrophobicContact CG1-CD1 4.26Å; V125-L205 HydrophobicContact CB-CD1 4.27Å; V125-L205 HydrophobicContact CG2-CD1 3.56Å; V125-L207 HydrophobicContact CG2-CD1 3.4Å
126	T	98	Very high	97.2	Very high	11 Å²	11	47.1 Å²	47.1	7%	0.067	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-42.9	178.2	-59.1	0	0	0	0	111.7	S122 Y123 L128 L129 L130 V136 R138 N144	S122-T126 PolarHBondContact O-N 2.85Å; S122-T126 PolarHBondContact O-OG1 3.26Å; Y123-T126 PolarHBondContact O-N 3.38Å; Y123-T126 VanDerWaalsContact O-N 3.15Å; T126-L128 VanDerWaalsContact C-N 3.33Å; T126-L128 PolarHBondContact O-N 3.09Å; T126-L129 PolarHBondContact O-N 3.3Å; T126-L130 HydrophobicContact CG2-CD1 4.01Å; T126-L130 HydrophobicContact CG2-CG 4.33Å; T126-L130 WeakPolarHBondContact O-CB 3.33Å; T126-L130 VanDerWaalsContact O-CG 3.3Å; T126-L130 WeakPolarHBondContact O-CG 3.42Å; T126-L130 PolarHBondContact O-N 3.38Å; T126-V136 HydrophobicContact CG2-CG1 4.01Å; T126-R138 HydrophobicContact CG2-CG 3.87Å; T126-R138 WeakPolarHBondContact OG1-CD 3.5Å; T126-R138 WeakPolarHBondContact OG1-CG 3.35Å; T126-R138 PolarHBondContact OG1-NH1 3.24Å; T126-N144 PolarHBondContact OG1-OD1 3.1Å
127	E	97.4	Very high	97.4	Very high	127 Å²	127	46.7 Å²	46.7	59%	0.593	24%	0.237	S	C	*	.	H	α-helix	trans	-61.5	-41	176.7	-75.3	174.9	-175.9	0	0	111.8	Y123 V125 L130 S131	Y123-E127 WeakPolarHBondContact O-CB 3.48Å; Y123-E127 WeakPolarHBondContact O-CG 3.39Å; Y123-E127 PolarHBondContact O-N 2.88Å; V125-E127 PolarHBondContact O-N 2.73Å; E127-L130 PolarHBondContact O-N 2.67Å; E127-S131 PolarHBondContact O-N 3.48Å; E127-S131 VanDerWaalsContact O-N 3.12Å
128	L	98.4	Very high	97.4	Very high	17 Å²	17	45 Å²	45	9%	0.089	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-47.1	174.2	177.1	57.9	0	0	0	111	Q124 V125 T126 L130 S131 F132 A200 I201 K204 L205	Q124-L128 VanDerWaalsContact O-CB 3.32Å; Q124-L128 WeakPolarHBondContact O-CB 3.47Å; Q124-L128 PolarHBondContact O-N 2.88Å; V125-L128 PolarHBondContact O-N 3.25Å; T126-L128 VanDerWaalsContact C-N 3.33Å; T126-L128 PolarHBondContact O-N 3.09Å; L128-L130 VanDerWaalsContact C-N 3.32Å; L128-L130 PolarHBondContact O-N 3.14Å; L128-S131 WeakPolarHBondContact O-CB 3.44Å; L128-S131 PolarHBondContact O-N 3.36Å; L128-S131 VanDerWaalsContact O-N 3.16Å; L128-S131 PolarHBondContact O-OG 2.75Å; L128-F132 HydrophobicContact CD1-CE2 4.15Å; L128-F132 HydrophobicContact CG-CE2 4.49Å; L128-F132 WeakPolarHBondContact O-CD2 3.42Å; L128-A200 HydrophobicContact CD2-CB 4.35Å; L128-I201 HydrophobicContact CD2-CB 4.44Å; L128-I201 HydrophobicContact CD2-CG1 3.9Å; L128-K204 HydrophobicContact CD1-CD 3.6Å; L128-K204 HydrophobicContact CD2-CB 4.39Å; L128-K204 HydrophobicContact CD2-CD 4.23Å; L128-L205 HydrophobicContact CD2-CD1 3.99Å; L128-L205 HydrophobicContact CD2-CG 4.25Å
129	L	98.3	Very high	97.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-38.2	176.6	-68.4	175.4	0	0	0	112.2	F49 V125 T126 S131 F132 C133 V136 N144 V146 M197 I201	F49-L129 HydrophobicContact CD2-CD1 4.22Å; F49-L129 HydrophobicContact CD2-CD2 4.35Å; F49-L129 HydrophobicContact CE2-CD2 4.08Å; F49-L129 HydrophobicContact CZ-CD2 4.26Å; V125-L129 HydrophobicContact CG1-CD1 4.26Å; V125-L129 WeakPolarHBondContact O-CG 3.49Å; V125-L129 PolarHBondContact O-N 3.45Å; T126-L129 PolarHBondContact O-N 3.3Å; L129-S131 PolarHBondContact O-N 3.28Å; L129-F132 WeakPolarHBondContact O-CB 3.45Å; L129-F132 PolarHBondContact O-N 3.03Å; L129-C133 PolarHBondContact O-N 3.48Å; L129-C133 VanDerWaalsContact O-N 3.12Å; L129-V136 HydrophobicContact CB-CG1 4.23Å; L129-V136 HydrophobicContact CB-CG2 4Å; L129-V136 HydrophobicContact CD1-CG1 4.43Å; L129-N144 HydrophobicContact CD1-CB 3.54Å; L129-V146 HydrophobicContact CD1-CG2 4.26Å; L129-M197 HydrophobicContact CD2-CB 4.07Å; L129-M197 HydrophobicContact CD2-CG 4.23Å; L129-M197 HydrophobicContact CD2-SD 3.97Å; L129-I201 HydrophobicContact CD2-CD1 4.15Å
130	L	97.3	Very high	97.3	Very high	77 Å²	77	48.8 Å²	48.8	40%	0.403	26%	0.264	S	S	.	.	H	α-helix	trans	-61.4	-28.2	175.7	-77.9	169	0	0	0	112.6	T126 E127 L128 F132 C133 V136	T126-L130 HydrophobicContact CG2-CD1 4.01Å; T126-L130 HydrophobicContact CG2-CG 4.33Å; T126-L130 WeakPolarHBondContact O-CB 3.33Å; T126-L130 VanDerWaalsContact O-CG 3.3Å; T126-L130 WeakPolarHBondContact O-CG 3.42Å; T126-L130 PolarHBondContact O-N 3.38Å; E127-L130 PolarHBondContact O-N 2.67Å; L128-L130 VanDerWaalsContact C-N 3.32Å; L128-L130 PolarHBondContact O-N 3.14Å; L130-F132 PolarHBondContact O-N 3.41Å; L130-C133 WeakPolarHBondContact CA-O 3.49Å; L130-V136 HydrophobicContact CD2-CB 3.87Å; L130-V136 HydrophobicContact CD2-CG2 3.83Å; L130-V136 HydrophobicContact CG-CB 4.18Å; L130-V136 HydrophobicContact CG-CG2 4.08Å
131	S	97	Very high	97.4	Very high	83 Å²	83	46.6 Å²	46.6	58%	0.58	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-20.2	173.7	80.3	0	0	0	0	113.7	E127 L128 L129	E127-S131 PolarHBondContact O-N 3.48Å; E127-S131 VanDerWaalsContact O-N 3.12Å; L128-S131 WeakPolarHBondContact O-CB 3.44Å; L128-S131 PolarHBondContact O-N 3.36Å; L128-S131 VanDerWaalsContact O-N 3.16Å; L128-S131 PolarHBondContact O-OG 2.75Å; L129-S131 PolarHBondContact O-N 3.28Å
132	F	96.9	Very high	97.4	Very high	64 Å²	64	47.7 Å²	47.7	28%	0.281	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-44.6	173.8	-71.4	-99.8	0	0	0	112.4	L128 L129 L130 M197 A200	L128-F132 HydrophobicContact CD1-CE2 4.15Å; L128-F132 HydrophobicContact CG-CE2 4.49Å; L128-F132 WeakPolarHBondContact O-CD2 3.42Å; L129-F132 WeakPolarHBondContact O-CB 3.45Å; L129-F132 PolarHBondContact O-N 3.03Å; L130-F132 PolarHBondContact O-N 3.41Å; F132-M197 HydrophobicContact CB-CE 3.38Å; F132-M197 HydrophobicContact CD1-CE 4.05Å; F132-M197 HydrophobicContact CD1-CG 3.94Å; F132-M197 HydrophobicContact CD2-CG 4.17Å; F132-M197 HydrophobicContact CE1-CG 4.11Å; F132-M197 HydrophobicContact CE2-CG 4.34Å; F132-M197 HydrophobicContact CG-CE 3.83Å; F132-M197 HydrophobicContact CG-CG 3.98Å; F132-M197 HydrophobicContact CZ-CG 4.3Å; F132-A200 HydrophobicContact CE2-CB 4Å; F132-A200 HydrophobicContact CZ-CB 3.75Å
133	C	94.6	Very high	97.4	Very high	13 Å²	13	49.1 Å²	49.1	9%	0.088	27%	0.266	C	S	.	.			trans	-145.9	135.3	-176.4	-179.3	0	0	0	0	110.7	L129 L130 L135 V136 V146 D147	L129-C133 PolarHBondContact O-N 3.48Å; L129-C133 VanDerWaalsContact O-N 3.12Å; L130-C133 WeakPolarHBondContact CA-O 3.49Å; C133-L135 VanDerWaalsContact C-N 3.25Å; C133-L135 PolarHBondContact O-N 3.41Å; C133-L135 PolarHBondContact SG-N 3.06Å; C133-L135 VanDerWaalsContact SG-N 3.4Å; C133-V136 VanDerWaalsContact O-CG2 3.31Å; C133-V136 WeakPolarHBondContact O-CG2 3.3Å; C133-V146 HydrophobicContact CB-CG1 3.72Å; C133-D147 PolarHBondContact SG-O 3.32Å
134	P	95.4	Very high	97.5	Very high	98 Å²	98	45.9 Å²	45.9	64%	0.636	25%	0.253	S	S	*	.	S	Bend	trans	-71.6	-15.9	177.7	29.4	-36	0	0	0	114.1	V136	P134-V136 PolarHBondContact O-N 3.46Å
135	L	97.6	Very high	97.6	Very high	67 Å²	67	42.4 Å²	42.4	35%	0.351	24%	0.237	S	C	.	.			trans	-91.8	75.5	-178.2	-63.2	177.3	0	0	0	111	C133 V146 D147 V307 P309	C133-L135 VanDerWaalsContact C-N 3.25Å; C133-L135 PolarHBondContact O-N 3.41Å; C133-L135 PolarHBondContact SG-N 3.06Å; C133-L135 VanDerWaalsContact SG-N 3.4Å; L135-V146 WeakPolarHBondContact O-CA 3.25Å; L135-D147 HydrophobicContact CB-CB 3.98Å; L135-D147 HydrophobicContact CD1-CB 3.97Å; L135-D147 PolarHBondContact O-N 2.8Å; L135-D147 VanDerWaalsContact O-N 3.15Å; L135-V307 WeakPolarHBondContact O-CG1 3.43Å; L135-P309 HydrophobicContact CD2-CG 4.05Å
136	V	98.3	Very high	97.6	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.8	177.5	-175.8	0	0	0	0	111	T126 L129 L130 C133 P134 N144 F145 V146 P309 T310	T126-V136 HydrophobicContact CG2-CG1 4.01Å; L129-V136 HydrophobicContact CB-CG1 4.23Å; L129-V136 HydrophobicContact CB-CG2 4Å; L129-V136 HydrophobicContact CD1-CG1 4.43Å; L130-V136 HydrophobicContact CD2-CB 3.87Å; L130-V136 HydrophobicContact CD2-CG2 3.83Å; L130-V136 HydrophobicContact CG-CB 4.18Å; L130-V136 HydrophobicContact CG-CG2 4.08Å; C133-V136 VanDerWaalsContact O-CG2 3.31Å; C133-V136 WeakPolarHBondContact O-CG2 3.3Å; P134-V136 PolarHBondContact O-N 3.46Å; V136-N144 HydrophobicContact CG1-CB 4.13Å; V136-F145 CarbonylContact C-O 3.59Å; V136-F145 VanDerWaalsContact CA-O 3.3Å; V136-F145 WeakPolarHBondContact CA-O 3.43Å; V136-V146 HydrophobicContact CG1-CG2 4.43Å; V136-V146 HydrophobicContact CG2-CG1 4.25Å; V136-V146 HydrophobicContact CG2-CG2 4.16Å; V136-P309 WeakPolarHBondContact O-CA 3.36Å; V136-T310 PolarHBondContact O-N 2.96Å
137	E	98.3	Very high	97.6	Very high	30 Å²	30	43 Å²	43	14%	0.14	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.5	176.4	-174.5	178.6	131	0	0	110.1	N144 F145 K217 V307 T308 T310	E137-N144 CarbonylContact O-C 3.52Å; E137-N144 VanDerWaalsContact O-CA 3.29Å; E137-N144 WeakPolarHBondContact O-CA 3.43Å; E137-F145 HydrophobicContact CB-CB 4.26Å; E137-F145 PolarHBondContact N-O 3.19Å; E137-F145 PolarHBondContact O-N 3.47Å; E137-K217 IonicContact OE1-NZ 3.13Å; E137-K217 PolarHBondContact OE1-NZ 3.35Å; E137-K217 IonicContact OE2-NZ 3.88Å; E137-K217 PolarHBondContact OE2-NZ 2.92Å; E137-V307 HydrophobicContact CB-CG1 3.66Å; E137-V307 WeakPolarHBondContact OE2-CA 3.38Å; E137-T308 WeakPolarHBondContact CA-O 3.47Å; E137-T308 WeakPolarHBondContact CB-O 3.45Å; E137-T308 WeakPolarHBondContact CG-O 3.37Å; E137-T308 PolarHBondContact OE2-N 3.08Å; E137-T308 PolarHBondContact OE2-OG1 3.21Å; E137-T310 WeakPolarHBondContact CA-OG1 3.43Å
138	R	97.8	Very high	97.6	Very high	30 Å²	30	36.9 Å²	36.9	11%	0.113	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	139.9	175.2	-64.9	169.6	55.6	91.9	5.7	110.9	S122 T126 G140 N144 T310	S122-R138 VanDerWaalsContact C-NH1 3.34Å; S122-R138 PolarHBondContact O-NH1 3.03Å; S122-R138 VanDerWaalsContact OG-CZ 3.27Å; S122-R138 PolarHBondContact OG-NH1 3.38Å; S122-R138 PolarHBondContact OG-NH2 3.45Å; T126-R138 HydrophobicContact CG2-CG 3.87Å; T126-R138 WeakPolarHBondContact OG1-CD 3.5Å; T126-R138 WeakPolarHBondContact OG1-CG 3.35Å; T126-R138 PolarHBondContact OG1-NH1 3.24Å; R138-G140 PolarHBondContact NH2-O 3.22Å; R138-N144 WeakPolarHBondContact CG-OD1 3.08Å; R138-T310 HydrophobicContact CB-CG2 4.22Å; R138-T310 PolarHBondContact N-OG1 2.71Å
139	L	96.6	Very high	97.6	Very high	81 Å²	81	37.3 Å²	37.3	42%	0.424	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	98.7	166.8	-179.4	58	0	0	0	108.5	E143 F145 K221	L139-E143 HydrophobicContact CB-CB 4.15Å; L139-E143 VanDerWaalsContact CD2-OE2 3.27Å; L139-E143 WeakPolarHBondContact CD2-OE2 3.39Å; L139-E143 PolarHBondContact N-O 3.27Å; L139-E143 VanDerWaalsContact O-CB 3.31Å; L139-E143 WeakPolarHBondContact O-CB 3.4Å; L139-F145 HydrophobicContact CB-CE2 4.21Å; L139-F145 HydrophobicContact CD2-CE2 3.95Å; L139-F145 HydrophobicContact CD2-CZ 4.44Å; L139-K221 HydrophobicContact CD2-CD 4.27Å
140	G	95.8	Very high	97.5	Very high	50 Å²	50	43.9 Å²	43.9	52%	0.515	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	-143.9	-172.6	0	0	0	0	0	113.1	R138	R138-G140 PolarHBondContact NH2-O 3.22Å
141	F	98	Very high	97.5	Very high	46 Å²	46	41.5 Å²	41.5	20%	0.202	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-28.7	-177.1	-78.2	7.9	0	0	0	113	F54 Y55 L115 R119 S122	F54-F141 HydrophobicContact CD1-CB 4.2Å; F54-F141 HydrophobicContact CE1-CB 3.81Å; Y55-F141 HydrophobicContact CE1-CD2 4.07Å; L115-F141 HydrophobicContact CB-CE2 4.23Å; L115-F141 HydrophobicContact CD1-CE2 4.41Å; R119-F141 HydrophobicContact CB-CE2 4.04Å; R119-F141 HydrophobicContact CB-CZ 4.06Å; R119-F141 HydrophobicContact CG-CZ 4.23Å; S122-F141 WeakPolarHBondContact CB-O 3.3Å; S122-F141 VanDerWaalsContact OG-C 3.3Å; S122-F141 WeakPolarHBondContact OG-CA 3.36Å; S122-F141 PolarHBondContact OG-O 2.96Å
142	D	98.4	Very high	97.5	Very high	50 Å²	50	37.5 Å²	37.5	27%	0.267	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-2.5	-170.2	54.1	-31.6	0	0	0	114	L51 F54	L51-D142 HydrophobicContact CB-CB 4.06Å; L51-D142 HydrophobicContact CD1-CB 4.42Å; L51-D142 HydrophobicContact CG-CB 4.48Å; L51-D142 WeakPolarHBondContact CG-O 3.35Å; L51-D142 PolarHBondContact N-O 3.46Å; F54-D142 HydrophobicContact CB-CB 3.54Å; F54-D142 HydrophobicContact CD1-CB 3.83Å; F54-D142 HydrophobicContact CD2-CB 4.32Å; F54-D142 HydrophobicContact CG-CB 3.65Å
143	E	98.7	Very high	97.5	Very high	30 Å²	30	37.9 Å²	37.9	14%	0.14	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.8	-179.8	-48.3	177.3	-174.8	0	0	113.7	H48 F49 D50 L139 K221	H48-E143 IonicContact CE1-OE2 2.73Å; H48-E143 IonicContact NE2-OE2 3.98Å; H48-E143 PolarHBondContact NE2-OE2 3.24Å; F49-E143 WeakPolarHBondContact O-CA 3.49Å; D50-E143 HydrophobicContact CB-CG 4.45Å; L139-E143 HydrophobicContact CB-CB 4.15Å; L139-E143 VanDerWaalsContact CD2-OE2 3.27Å; L139-E143 WeakPolarHBondContact CD2-OE2 3.39Å; L139-E143 PolarHBondContact N-O 3.27Å; L139-E143 VanDerWaalsContact O-CB 3.31Å; L139-E143 WeakPolarHBondContact O-CB 3.4Å; E143-K221 IonicContact OE1-NZ 2.72Å; E143-K221 PolarHBondContact OE1-NZ 3.22Å; E143-K221 IonicContact OE2-NZ 3.62Å; E143-K221 PolarHBondContact OE2-NZ 2.91Å
144	N	98.7	Very high	97.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	135	174.5	-66.6	-100.8	0	0	0	110.7	H48 F49 T126 L129 V136 E137 R138	H48-N144 CarbonylContact C-O 3.55Å; H48-N144 WeakPolarHBondContact CA-O 3.33Å; F49-N144 PolarHBondContact N-O 3.24Å; F49-N144 PolarHBondContact O-N 3.03Å; T126-N144 PolarHBondContact OG1-OD1 3.1Å; L129-N144 HydrophobicContact CD1-CB 3.54Å; V136-N144 HydrophobicContact CG1-CB 4.13Å; E137-N144 CarbonylContact O-C 3.52Å; E137-N144 VanDerWaalsContact O-CA 3.29Å; E137-N144 WeakPolarHBondContact O-CA 3.43Å; R138-N144 WeakPolarHBondContact CG-OD1 3.08Å
145	F	98.8	Very high	97.5	Very high	11 Å²	11	41.8 Å²	41.8	5%	0.048	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	142.7	163.9	-63	-84.1	0	0	0	110.4	I46 L47 H48 V136 E137 L139 K217 K221 V307	I46-F145 HydrophobicContact CG2-CD1 4.28Å; L47-F145 CarbonylContact O-C 3.56Å; L47-F145 VanDerWaalsContact O-CA 3.24Å; L47-F145 WeakPolarHBondContact O-CA 3.17Å; H48-F145 HydrophobicContact CB-CD1 3.88Å; H48-F145 HydrophobicContact CB-CE1 3.84Å; H48-F145 AromaticContact CD2-CD1 3.76Å; H48-F145 AromaticContact CD2-CE1 3.33Å; H48-F145 WeakPolarHBondContact CD2-CE1 3.23Å; H48-F145 AromaticContact CD2-CE2 3.99Å; H48-F145 AromaticContact CD2-CZ 3.48Å; H48-F145 VanDerWaalsContact CD2-CZ 3.48Å; H48-F145 WeakPolarHBondContact CD2-CZ 3.29Å; H48-F145 AromaticContact CG-CE1 3.84Å; V136-F145 CarbonylContact C-O 3.59Å; V136-F145 VanDerWaalsContact CA-O 3.3Å; V136-F145 WeakPolarHBondContact CA-O 3.43Å; E137-F145 HydrophobicContact CB-CB 4.26Å; E137-F145 PolarHBondContact N-O 3.19Å; E137-F145 PolarHBondContact O-N 3.47Å; L139-F145 HydrophobicContact CB-CE2 4.21Å; L139-F145 HydrophobicContact CD2-CE2 3.95Å; L139-F145 HydrophobicContact CD2-CZ 4.44Å; F145-K217 HydrophobicContact CB-CD 4.22Å; F145-K217 HydrophobicContact CB-CG 4.5Å; F145-K217 HydrophobicContact CD1-CB 3.9Å; F145-K217 HydrophobicContact CD1-CD 4.07Å; F145-K217 HydrophobicContact CD1-CG 3.79Å; F145-K217 HydrophobicContact CD2-CD 4.08Å; F145-K217 HydrophobicContact CE1-CB 3.71Å; F145-K217 HydrophobicContact CE1-CD 4.46Å; F145-K217 HydrophobicContact CE1-CG 4.14Å; F145-K217 VanDerWaalsContact CE1-O 3.3Å; F145-K217 WeakPolarHBondContact CE1-O 3.48Å; F145-K217 HydrophobicContact CE2-CD 4.47Å; F145-K217 HydrophobicContact CG-CD 3.85Å; F145-K217 HydrophobicContact CG-CG 4.08Å; F145-K217 HydrophobicContact CZ-CB 4.2Å; F145-K221 HydrophobicContact CE1-CB 3.97Å; F145-K221 HydrophobicContact CZ-CB 3.97Å; F145-K221 HydrophobicContact CZ-CD 4.17Å; F145-V307 HydrophobicContact CB-CG1 4.14Å; F145-V307 HydrophobicContact CB-CG2 4.05Å
146	V	98.8	Very high	97.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	126	174.8	-168.1	0	0	0	0	109.1	L47 F49 L129 C133 L135 V136 V148 M197	L47-V146 HydrophobicContact CB-CB 4.27Å; L47-V146 PolarHBondContact N-O 3.09Å; L47-V146 PolarHBondContact O-N 3.46Å; F49-V146 HydrophobicContact CD2-CG2 4.07Å; F49-V146 HydrophobicContact CE2-CB 4.5Å; F49-V146 HydrophobicContact CE2-CG2 3.79Å; L129-V146 HydrophobicContact CD1-CG2 4.26Å; C133-V146 HydrophobicContact CB-CG1 3.72Å; L135-V146 WeakPolarHBondContact O-CA 3.25Å; V136-V146 HydrophobicContact CG1-CG2 4.43Å; V136-V146 HydrophobicContact CG2-CG1 4.25Å; V136-V146 HydrophobicContact CG2-CG2 4.16Å; V146-V148 HydrophobicContact CB-CG1 4.29Å; V146-V148 HydrophobicContact CG1-CG1 3.7Å; V146-M197 HydrophobicContact CG1-CE 4.31Å
147	D	98.5	Very high	96.9	Very high	24 Å²	24	44.7 Å²	44.7	13%	0.128	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	108.8	170.2	-169.4	-31.7	0	0	0	108.9	I46 C133 L135 T149 V307	I46-D147 HydrophobicContact CD1-CB 3.8Å; I46-D147 VanDerWaalsContact CD1-CG 3.49Å; I46-D147 WeakPolarHBondContact CD1-OD2 3.43Å; C133-D147 PolarHBondContact SG-O 3.32Å; L135-D147 HydrophobicContact CB-CB 3.98Å; L135-D147 HydrophobicContact CD1-CB 3.97Å; L135-D147 PolarHBondContact O-N 2.8Å; L135-D147 VanDerWaalsContact O-N 3.15Å; D147-T149 WeakPolarHBondContact OD1-CB 3.2Å; D147-T149 PolarHBondContact OD1-N 3.18Å; D147-T149 PolarHBondContact OD1-OG1 3.36Å; D147-V307 HydrophobicContact CB-CB 3.92Å; D147-V307 HydrophobicContact CB-CG2 3.91Å
148	V	98.4	Very high	96.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.258	C	S	.	.			trans	-105.1	13.3	-177.2	-61	0	0	0	0	112.4	V45 L47 V146 E150 M151 V152 I193 M197	V45-V148 HydrophobicContact CB-CG2 4.06Å; V45-V148 HydrophobicContact CG1-CG2 3.72Å; V45-V148 WeakPolarHBondContact O-CG2 3.42Å; V45-V148 PolarHBondContact O-N 3.24Å; L47-V148 HydrophobicContact CD1-CB 4.42Å; L47-V148 HydrophobicContact CD1-CG1 3.57Å; L47-V148 HydrophobicContact CD1-CG2 4.01Å; L47-V148 HydrophobicContact CD2-CG2 3.97Å; L47-V148 HydrophobicContact CG-CB 4.49Å; L47-V148 HydrophobicContact CG-CG1 3.9Å; L47-V148 HydrophobicContact CG-CG2 3.75Å; V146-V148 HydrophobicContact CB-CG1 4.29Å; V146-V148 HydrophobicContact CG1-CG1 3.7Å; V148-E150 VanDerWaalsContact C-N 3.34Å; V148-E150 PolarHBondContact O-N 3.39Å; V148-M151 PolarHBondContact O-N 3.31Å; V148-V152 HydrophobicContact CG2-CG2 3.99Å; V148-V152 WeakPolarHBondContact O-CG2 3.31Å; V148-V152 PolarHBondContact O-N 2.91Å; V148-I193 HydrophobicContact CB-CD1 4.44Å; V148-I193 HydrophobicContact CB-CG2 4.41Å; V148-I193 HydrophobicContact CG1-CG2 4Å; V148-I193 HydrophobicContact CG2-CD1 4.48Å; V148-M197 HydrophobicContact CG1-CE 4.01Å
149	T	97.8	Very high	95.9	Very high	25 Å²	25	52.5 Å²	52.5	15%	0.153	27%	0.267	C	S	.	.	H	α-helix	trans	-52.7	-49.9	-174.9	-52.7	0	0	0	0	111.4	R44 V45 D147 M151 V152 E153	R44-T149 VanDerWaalsContact CA-OG1 3.31Å; R44-T149 WeakPolarHBondContact CA-OG1 3.4Å; V45-T149 PolarHBondContact N-OG1 2.8Å; D147-T149 WeakPolarHBondContact OD1-CB 3.2Å; D147-T149 PolarHBondContact OD1-N 3.18Å; D147-T149 PolarHBondContact OD1-OG1 3.36Å; T149-M151 VanDerWaalsContact C-N 3.33Å; T149-M151 PolarHBondContact O-N 2.78Å; T149-V152 PolarHBondContact O-N 3.33Å; T149-E153 WeakPolarHBondContact O-CG 3.44Å; T149-E153 PolarHBondContact O-N 3.4Å
150	E	96.4	Very high	95.1	Very high	139 Å²	139	51.9 Å²	51.9	65%	0.65	27%	0.269	S	S	*	.	H	α-helix	trans	-63.9	-37.6	179	-164.4	-163.1	140	0	0	112.5	V148 V152 E153 R154	V148-E150 VanDerWaalsContact C-N 3.34Å; V148-E150 PolarHBondContact O-N 3.39Å; E150-V152 VanDerWaalsContact C-N 3.35Å; E150-E153 PolarHBondContact O-N 3.02Å; E150-R154 WeakPolarHBondContact O-CB 3.34Å; E150-R154 PolarHBondContact O-N 2.76Å; E150-R154 IonicContact OE1-CZ 2.61Å; E150-R154 IonicContact OE1-NH2 2.77Å; E150-R154 PolarHBondContact OE1-NH2 2.64Å
151	M	97.1	Very high	93.8	Very high	26 Å²	26	59.7 Å²	59.7	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-69.6	-36.2	179.4	-164.1	162.7	95.4	0	0	111.7	V148 T149 R155 I193 M197	V148-M151 PolarHBondContact O-N 3.31Å; T149-M151 VanDerWaalsContact C-N 3.33Å; T149-M151 PolarHBondContact O-N 2.78Å; M151-R155 WeakPolarHBondContact O-CG 3.46Å; M151-R155 PolarHBondContact O-N 2.68Å; M151-R155 VanDerWaalsContact O-N 3.14Å; M151-I193 HydrophobicContact CB-CD1 4.32Å; M151-I193 HydrophobicContact CE-CB 3.92Å; M151-I193 HydrophobicContact CE-CD1 3.53Å; M151-I193 HydrophobicContact CE-CG1 3.45Å; M151-I193 VanDerWaalsContact CE-CG1 3.45Å; M151-I193 HydrophobicContact CE-CG2 3.23Å; M151-I193 HydrophobicContact CG-CD1 4.18Å; M151-M197 HydrophobicContact CE-CE 4.37Å
152	V	97.1	Very high	92.2	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.1	-51.9	173	168	0	0	0	0	110.4	V45 V148 T149 E150 R154 R155 L156 R186 I189 I193	V45-V152 HydrophobicContact CB-CG2 4.08Å; V45-V152 HydrophobicContact CG1-CG2 4.1Å; V45-V152 HydrophobicContact CG2-CB 4.47Å; V45-V152 HydrophobicContact CG2-CG1 4.26Å; V45-V152 HydrophobicContact CG2-CG2 4.17Å; V148-V152 HydrophobicContact CG2-CG2 3.99Å; V148-V152 WeakPolarHBondContact O-CG2 3.31Å; V148-V152 PolarHBondContact O-N 2.91Å; T149-V152 PolarHBondContact O-N 3.33Å; E150-V152 VanDerWaalsContact C-N 3.35Å; V152-R154 VanDerWaalsContact C-N 3.28Å; V152-R154 PolarHBondContact O-N 2.7Å; V152-R155 PolarHBondContact O-N 3.15Å; V152-L156 WeakPolarHBondContact O-CB 3.29Å; V152-L156 PolarHBondContact O-N 2.92Å; V152-R186 HydrophobicContact CG1-CB 3.87Å; V152-R186 HydrophobicContact CG1-CG 3.98Å; V152-I189 HydrophobicContact CB-CG2 4.33Å; V152-I189 HydrophobicContact CG1-CB 4.22Å; V152-I189 HydrophobicContact CG1-CG2 4.25Å; V152-I189 HydrophobicContact CG2-CB 4.47Å; V152-I189 HydrophobicContact CG2-CG2 4.06Å; V152-I193 HydrophobicContact CG2-CD1 3.69Å
153	E	95.8	Very high	91	Very high	71 Å²	71	63.9 Å²	63.9	33%	0.332	33%	0.325	S	S	.	.	H	α-helix	trans	-58.2	-41	178.9	-66.8	-58.5	152.1	0	0	111.7	T149 E150 R155 L156 A157 R186	T149-E153 WeakPolarHBondContact O-CG 3.44Å; T149-E153 PolarHBondContact O-N 3.4Å; E150-E153 PolarHBondContact O-N 3.02Å; E153-R155 VanDerWaalsContact C-N 3.31Å; E153-R155 PolarHBondContact O-N 2.75Å; E153-L156 PolarHBondContact O-N 3.37Å; E153-A157 WeakPolarHBondContact O-CB 3.49Å; E153-A157 PolarHBondContact O-N 3.04Å; E153-R186 IonicContact OE1-CZ 2.67Å; E153-R186 IonicContact OE1-NE 3.21Å; E153-R186 PolarHBondContact OE1-NE 3.41Å; E153-R186 IonicContact OE1-NH2 2.83Å; E153-R186 PolarHBondContact OE1-NH2 2.81Å; E153-R186 VanDerWaalsContact OE1-NH2 3.09Å; E153-R186 IonicContact OE2-NH2 2.88Å; E153-R186 PolarHBondContact OE2-NH2 2.95Å
154	R	95.1	Very high	90.3	Very high	130 Å²	130	68 Å²	68	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-66.3	-29.6	177.3	-161.4	-170.4	-57.3	142	3.1	113.4	E150 V152 R158	E150-R154 WeakPolarHBondContact O-CB 3.34Å; E150-R154 PolarHBondContact O-N 2.76Å; E150-R154 IonicContact OE1-CZ 2.61Å; E150-R154 IonicContact OE1-NH2 2.77Å; E150-R154 PolarHBondContact OE1-NH2 2.64Å; V152-R154 VanDerWaalsContact C-N 3.28Å; V152-R154 PolarHBondContact O-N 2.7Å; R154-R158 PolarHBondContact O-NE 3.49Å; R154-R158 PolarHBondContact O-NH2 3.31Å
155	R	94.9	Very high	89.7	Confident	63 Å²	63	69.9 Å²	69.9	24%	0.238	37%	0.367	C	S	.	.	H	α-helix	trans	-80.7	-39.8	175	-74.1	-176.5	-173.2	-151.6	1.5	110.7	M151 V152 E153 A157 R158 I159 I189 E196	M151-R155 WeakPolarHBondContact O-CG 3.46Å; M151-R155 PolarHBondContact O-N 2.68Å; M151-R155 VanDerWaalsContact O-N 3.14Å; V152-R155 PolarHBondContact O-N 3.15Å; E153-R155 VanDerWaalsContact C-N 3.31Å; E153-R155 PolarHBondContact O-N 2.75Å; R155-A157 VanDerWaalsContact C-N 3.32Å; R155-A157 PolarHBondContact O-N 2.72Å; R155-R158 PolarHBondContact O-N 2.96Å; R155-I159 PolarHBondContact O-N 2.83Å; R155-I189 HydrophobicContact CB-CD1 4.44Å; R155-I189 HydrophobicContact CB-CG2 3.81Å; R155-I189 HydrophobicContact CG-CG2 4.39Å; R155-E196 IonicContact CZ-OE1 3.89Å; R155-E196 IonicContact CZ-OE2 3.42Å; R155-E196 IonicContact NH1-OE1 2.71Å; R155-E196 PolarHBondContact NH1-OE1 2.92Å; R155-E196 IonicContact NH1-OE2 3.18Å; R155-E196 PolarHBondContact NH1-OE2 3.01Å; R155-E196 IonicContact NH2-OE1 2.74Å; R155-E196 PolarHBondContact NH2-OE1 2.82Å; R155-E196 IonicContact NH2-OE2 2.7Å; R155-E196 PolarHBondContact NH2-OE2 2.84Å
156	L	92	Very high	89.4	Confident	42 Å²	42	71.6 Å²	71.6	22%	0.22	38%	0.38	C	S	.	.	H	α-helix	trans	-60.2	-41.2	176.5	-170.7	61.6	0	0	0	111.7	V152 E153 R158 I159 P185 R186 I189	V152-L156 WeakPolarHBondContact O-CB 3.29Å; V152-L156 PolarHBondContact O-N 2.92Å; E153-L156 PolarHBondContact O-N 3.37Å; L156-R158 PolarHBondContact O-N 3.38Å; L156-R158 VanDerWaalsContact O-N 3.12Å; L156-I159 HydrophobicContact CD1-CD1 4.43Å; L156-I159 PolarHBondContact O-N 3.02Å; L156-I159 VanDerWaalsContact O-N 3.17Å; L156-P185 HydrophobicContact CD1-CB 3.89Å; L156-P185 HydrophobicContact CD1-CG 4.5Å; L156-R186 HydrophobicContact CD2-CG 4.33Å; L156-I189 HydrophobicContact CB-CD1 3.78Å; L156-I189 HydrophobicContact CD1-CD1 3.79Å; L156-I189 HydrophobicContact CG-CD1 4.37Å
157	A	91.7	Very high	89.2	Confident	89 Å²	89	72.6 Å²	72.6	74%	0.736	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-12.7	176.4	0	0	0	0	0	114.9	E153 R155	E153-A157 WeakPolarHBondContact O-CB 3.49Å; E153-A157 PolarHBondContact O-N 3.04Å; R155-A157 VanDerWaalsContact C-N 3.32Å; R155-A157 PolarHBondContact O-N 2.72Å
158	R	89.4	Confident	89	Confident	169 Å²	169	76.6 Å²	76.6	64%	0.638	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-11	178	-77.9	179.6	-87.6	160.4	-7	113.3	R154 R155 L156	R154-R158 PolarHBondContact O-NE 3.49Å; R154-R158 PolarHBondContact O-NH2 3.31Å; R155-R158 PolarHBondContact O-N 2.96Å; L156-R158 PolarHBondContact O-N 3.38Å; L156-R158 VanDerWaalsContact O-N 3.12Å
159	I	86.6	Confident	88.8	Confident	56 Å²	56	78.8 Å²	78.8	29%	0.287	42%	0.424	S	S	.	.			trans	-77.1	131.2	179.5	-79.7	158.6	0	0	0	109	R155 L156 D163 L165 I189	R155-I159 PolarHBondContact O-N 2.83Å; L156-I159 HydrophobicContact CD1-CD1 4.43Å; L156-I159 PolarHBondContact O-N 3.02Å; L156-I159 VanDerWaalsContact O-N 3.17Å; I159-D163 WeakPolarHBondContact CA-OD2 3.45Å; I159-D163 HydrophobicContact CG2-CB 3.94Å; I159-L165 HydrophobicContact CD1-CD2 3.92Å; I159-I189 HydrophobicContact CD1-CD1 3.56Å; I159-I189 HydrophobicContact CD1-CG1 4.06Å
160	S	78.7	Confident	88.7	Confident	68 Å²	68	79.9 Å²	79.9	48%	0.476	43%	0.429	S	S	.	.			trans	-87.2	158.7	173.5	-61.4	0	0	0	0	110.4	S162 D163	S160-S162 PolarHBondContact O-N 3.28Å; S160-D163 PolarHBondContact N-OD2 2.93Å; S160-D163 PolarHBondContact O-N 3.49Å
161	E	68.1	Low	88.6	Confident	213 Å²	213	74 Å²	74	100%	0.995	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.6	178	-70.1	-176.2	168.3	0	0	113.8
162	S	65	Low	88.4	Confident	104 Å²	104	73.8 Å²	73.8	73%	0.727	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-11	176.8	55.2	0	0	0	0	115.1	S160 S164	S160-S162 PolarHBondContact O-N 3.28Å; S162-S164 PolarHBondContact O-N 3.15Å
163	D	74.5	Confident	87.8	Confident	81 Å²	81	78.8 Å²	78.8	43%	0.433	43%	0.427	S	S	.	.			trans	-81.6	119.4	-173.7	-59.5	-30.2	0	0	0	110.7	I159 S160 L165	I159-D163 WeakPolarHBondContact CA-OD2 3.45Å; I159-D163 HydrophobicContact CG2-CB 3.94Å; S160-D163 PolarHBondContact N-OD2 2.93Å; S160-D163 PolarHBondContact O-N 3.49Å; D163-L165 PolarHBondContact O-N 3.46Å
164	S	82.3	Confident	86.6	Confident	117 Å²	117	79 Å²	79	82%	0.818	43%	0.428	S	S	*	.			trans	-71.4	111.8	174.4	61.6	0	0	0	0	110.4	S162	S162-S164 PolarHBondContact O-N 3.15Å
165	L	87.8	Confident	84.9	Confident	39 Å²	39	79.3 Å²	79.3	20%	0.204	45%	0.45	C	S	.	.			trans	-76.8	139.8	172.8	-74.7	165.7	0	0	0	110.6	I159 D163 A181 P185 I189	I159-L165 HydrophobicContact CD1-CD2 3.92Å; D163-L165 PolarHBondContact O-N 3.46Å; L165-A181 HydrophobicContact CB-CB 4.12Å; L165-A181 VanDerWaalsContact O-CB 3.25Å; L165-A181 WeakPolarHBondContact O-CB 3.5Å; L165-P185 HydrophobicContact CD1-CB 3.55Å; L165-I189 HydrophobicContact CD2-CG1 4.24Å
166	S	92.6	Very high	83	Confident	47 Å²	47	79.1 Å²	79.1	33%	0.329	46%	0.459	S	S	.	.			trans	-142.2	154.3	174.1	56.5	0	0	0	0	110	H192	S166-H192 PolarHBondContact O-CD2 2.93Å; S166-H192 PolarHBondContact O-NE2 3.15Å
167	F	93.4	Very high	81.3	Confident	21 Å²	21	79.4 Å²	79.4	9%	0.092	47%	0.467	C	S	.	.			trans	-80.7	149.4	169.8	-66.1	-76.2	0	0	0	111	V171 N180 A181 H184 L187 A188 V234 L236	F167-V171 HydrophobicContact CB-CG2 3.9Å; F167-V171 HydrophobicContact CD1-CG2 4.4Å; F167-V171 HydrophobicContact CD2-CG2 3.63Å; F167-V171 HydrophobicContact CE2-CG2 4.22Å; F167-V171 HydrophobicContact CG-CG2 3.73Å; F167-N180 HydrophobicContact CE2-CB 4.49Å; F167-A181 HydrophobicContact CD2-CB 3.89Å; F167-A181 VanDerWaalsContact CE2-CA 3.46Å; F167-A181 HydrophobicContact CE2-CB 3.79Å; F167-A181 HydrophobicContact CZ-CB 4.39Å; F167-H184 HydrophobicContact CZ-CB 4.04Å; F167-L187 HydrophobicContact CE1-CB 4.12Å; F167-A188 VanDerWaalsContact CD1-CA 3.48Å; F167-A188 HydrophobicContact CD1-CB 3.92Å; F167-A188 HydrophobicContact CE1-CB 3.83Å; F167-A188 HydrophobicContact CZ-CB 4.38Å; F167-V234 HydrophobicContact CD1-CB 4.34Å; F167-V234 HydrophobicContact CD1-CG1 4.15Å; F167-V234 HydrophobicContact CD1-CG2 4Å; F167-V234 HydrophobicContact CE1-CG1 3.93Å; F167-L236 HydrophobicContact CE1-CD2 4.14Å; F167-L236 HydrophobicContact CZ-CD2 3.73Å
168	K	95.4	Very high	79.5	Confident	108 Å²	108	81.5 Å²	81.5	47%	0.47	47%	0.465	S	S	.	.	S	Bend	trans	-105.3	121.5	168.9	-167.5	66.9	174.5	-175.7	0	109.4	S191 A195 Q232	K168-S191 PolarHBondContact N-OG 3.44Å; K168-A195 HydrophobicContact CB-CB 4.35Å; K168-A195 HydrophobicContact CG-CB 3.52Å; K168-Q232 PolarHBondContact O-NE2 3.32Å
169	G	94.2	Very high	77.8	Confident	47 Å²	47	76.2 Å²	76.2	49%	0.485	46%	0.458	S	S	.	.	S	Bend	trans	90.8	-155.3	-176.4	0	0	0	0	0	112.6
170	N	94.9	Very high	76.7	Confident	48 Å²	48	75 Å²	75	26%	0.257	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	149.6	-175.3	-57.6	-55.9	0	0	0	111.3	F227 Q231 Q232 T233 V234	N170-F227 HydrophobicContact CB-CD2 3.79Å; N170-F227 HydrophobicContact CB-CE2 3.81Å; N170-F227 HydrophobicContact CB-CG 4.47Å; N170-F227 HydrophobicContact CB-CZ 4.49Å; N170-F227 WeakPolarHBondContact ND2-CG 3.24Å; N170-Q231 PolarHBondContact ND2-OE1 2.87Å; N170-Q232 WeakPolarHBondContact CB-O 3.39Å; N170-Q232 PolarHBondContact N-O 3.47Å; N170-Q232 PolarHBondContact ND2-O 3.33Å; N170-T233 HydrophobicContact CB-CG2 4.13Å; N170-T233 CarbonylContact O-C 3.57Å; N170-T233 VanDerWaalsContact O-CA 3.31Å; N170-T233 WeakPolarHBondContact O-CA 3.42Å; N170-V234 PolarHBondContact O-N 2.83Å
171	V	94.2	Very high	76.8	Confident	14 Å²	14	71.8 Å²	71.8	9%	0.085	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.4	166.1	-178.1	0	0	0	0	107.2	F167 N173 H174 L236	F167-V171 HydrophobicContact CB-CG2 3.9Å; F167-V171 HydrophobicContact CD1-CG2 4.4Å; F167-V171 HydrophobicContact CD2-CG2 3.63Å; F167-V171 HydrophobicContact CE2-CG2 4.22Å; F167-V171 HydrophobicContact CG-CG2 3.73Å; V171-N173 PolarHBondContact O-N 3.43Å; V171-H174 HydrophobicContact CB-CB 4.38Å; V171-H174 HydrophobicContact CG1-CB 3.96Å; V171-L236 HydrophobicContact CG1-CD1 3.85Å; V171-L236 HydrophobicContact CG1-CG 3.96Å
172	F	92.8	Very high	77.5	Confident	22 Å²	22	65.5 Å²	65.5	10%	0.096	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	133.2	-176.9	-178.3	-95.1	0	0	0	111.1	H174 V223 T226 T233 V234 L235 N239 D242 I243	F172-H174 PolarHBondContact O-N 3.07Å; F172-H174 VanDerWaalsContact O-N 3.15Å; F172-V223 HydrophobicContact CB-CG2 3.97Å; F172-V223 HydrophobicContact CD2-CG2 4.27Å; F172-V223 HydrophobicContact CG-CG2 4.33Å; F172-T226 HydrophobicContact CD2-CG2 3.89Å; F172-T226 HydrophobicContact CE2-CG2 4.03Å; F172-T233 HydrophobicContact CB-CG2 4.06Å; F172-V234 PolarHBondContact N-O 3.28Å; F172-L235 HydrophobicContact CB-CD1 3.95Å; F172-L235 HydrophobicContact CD1-CD1 3.6Å; F172-L235 HydrophobicContact CE1-CD1 4.36Å; F172-L235 HydrophobicContact CG-CD1 3.9Å; F172-N239 HydrophobicContact CD1-CB 3.88Å; F172-N239 HydrophobicContact CE1-CB 4.37Å; F172-D242 HydrophobicContact CE1-CB 4Å; F172-I243 HydrophobicContact CD1-CB 4.42Å; F172-I243 HydrophobicContact CD2-CD1 4.49Å; F172-I243 HydrophobicContact CE1-CB 3.79Å; F172-I243 HydrophobicContact CE1-CG1 4.45Å; F172-I243 HydrophobicContact CE2-CB 4.45Å; F172-I243 HydrophobicContact CE2-CD1 4.35Å; F172-I243 HydrophobicContact CE2-CG1 4.24Å; F172-I243 HydrophobicContact CZ-CB 3.81Å; F172-I243 HydrophobicContact CZ-CG1 4.04Å
173	N	84.1	Confident	78.6	Confident	106 Å²	106	67.1 Å²	67.1	57%	0.567	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	30.1	176.2	-155.4	23.3	0	0	0	115.4	V171 D242	V171-N173 PolarHBondContact O-N 3.43Å; N173-D242 PolarHBondContact ND2-OD2 2.72Å
174	H	71.8	Confident	79.4	Confident	76 Å²	76	65.1 Å²	65.1	35%	0.352	39%	0.393	S	S	.	.			trans	-135.7	122.8	179.2	-148.3	42.1	0	0	0	113.8	V171 F172 S176 N180	V171-H174 HydrophobicContact CB-CB 4.38Å; V171-H174 HydrophobicContact CG1-CB 3.96Å; F172-H174 PolarHBondContact O-N 3.07Å; F172-H174 VanDerWaalsContact O-N 3.15Å; H174-S176 PolarHBondContact CD2-O 2.82Å; H174-S176 PolarHBondContact NE2-O 3.04Å; H174-N180 PolarHBondContact CD2-ND2 2.83Å; H174-N180 PolarHBondContact NE2-ND2 2.89Å
175	S	59.2	Low	79.9	Confident	135 Å²	135	60.9 Å²	60.9	94%	0.944	36%	0.363	S	S	*	.	S	Bend	trans	-87.6	-8.2	-179.4	-48.9	0	0	0	0	114.2
176	S	55.3	Low	80.2	Confident	60 Å²	60	63 Å²	63	42%	0.42	37%	0.368	S	S	.	.			trans	-124.5	88.8	-177.3	138.2	0	0	0	0	110.3	H174 D178	H174-S176 PolarHBondContact CD2-O 2.82Å; H174-S176 PolarHBondContact NE2-O 3.04Å; S176-D178 VanDerWaalsContact C-N 3.35Å; S176-D178 PolarHBondContact O-N 2.94Å
177	A	55.6	Low	80.4	Confident	47 Å²	47	61.3 Å²	61.3	39%	0.388	36%	0.355	S	S	.	.	S	Bend	trans	-71	-20.8	-170.4	0	0	0	0	0	115.2
178	D	53	Low	80.4	Confident	133 Å²	133	60.3 Å²	60.3	71%	0.711	35%	0.351	S	S	*	.	S	Bend	trans	-91.4	-23.6	-170.9	-66.6	-28.8	0	0	0	114.2	S176 N180	S176-D178 VanDerWaalsContact C-N 3.35Å; S176-D178 PolarHBondContact O-N 2.94Å; D178-N180 VanDerWaalsContact C-N 3.3Å; D178-N180 PolarHBondContact O-N 3.2Å
179	A	53.8	Low	80.5	Confident	59 Å²	59	55.6 Å²	55.6	49%	0.488	33%	0.331	S	S	.	.	S	Bend	trans	-75.5	-13.5	-175.3	0	0	0	0	0	114.5
180	N	64.3	Low	80.6	Confident	30 Å²	30	53.4 Å²	53.4	16%	0.16	31%	0.308	C	S	.	.	S	Bend	trans	-121.1	-5.6	-167.6	-83.1	-17.5	0	0	0	115.6	F167 H174 D178 H183 H184 L236	F167-N180 HydrophobicContact CE2-CB 4.49Å; H174-N180 PolarHBondContact CD2-ND2 2.83Å; H174-N180 PolarHBondContact NE2-ND2 2.89Å; D178-N180 VanDerWaalsContact C-N 3.3Å; D178-N180 PolarHBondContact O-N 3.2Å; N180-H183 PolarHBondContact O-N 3.18Å; N180-H183 PolarHBondContact OD1-ND1 3.41Å; N180-H184 PolarHBondContact O-CD2 3.13Å; N180-H184 PolarHBondContact O-N 3.26Å; N180-H184 VanDerWaalsContact O-N 3.16Å; N180-L236 HydrophobicContact CB-CD1 4.38Å
181	A	79.9	Confident	80.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-37.4	179.7	0	0	0	0	0	112.1	L165 F167 H183 H184 P185 A188	L165-A181 HydrophobicContact CB-CB 4.12Å; L165-A181 VanDerWaalsContact O-CB 3.25Å; L165-A181 WeakPolarHBondContact O-CB 3.5Å; F167-A181 HydrophobicContact CD2-CB 3.89Å; F167-A181 VanDerWaalsContact CE2-CA 3.46Å; F167-A181 HydrophobicContact CE2-CB 3.79Å; F167-A181 HydrophobicContact CZ-CB 4.39Å; A181-H183 VanDerWaalsContact C-N 3.3Å; A181-H183 PolarHBondContact O-N 2.79Å; A181-H184 CarbonylContact O-C 3.21Å; A181-H184 PolarHBondContact O-N 3.08Å; A181-P185 WeakPolarHBondContact O-CA 3.37Å; A181-A188 HydrophobicContact CB-CB 4.23Å
182	S	84.2	Confident	81	Confident	82 Å²	82	53.5 Å²	53.5	57%	0.573	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-30.3	175.4	-53.1	0	0	0	0	113
183	H	87.6	Confident	81.2	Confident	138 Å²	138	52.5 Å²	52.5	64%	0.639	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-24.9	175.4	-62	148.7	0	0	0	112.6	N180 A181 P185	N180-H183 PolarHBondContact O-N 3.18Å; N180-H183 PolarHBondContact OD1-ND1 3.41Å; A181-H183 VanDerWaalsContact C-N 3.3Å; A181-H183 PolarHBondContact O-N 2.79Å; H183-P185 WeakPolarHBondContact O-CD 3.42Å
184	H	91.1	Very high	81.9	Confident	38 Å²	38	47.4 Å²	47.4	18%	0.176	27%	0.274	C	S	.	.	S	Bend	trans	-125.8	56.2	-177.7	-62	-77.4	0	0	0	112.1	F167 N180 A181 R186 L187 A188 L236 E238	F167-H184 HydrophobicContact CZ-CB 4.04Å; N180-H184 PolarHBondContact O-CD2 3.13Å; N180-H184 PolarHBondContact O-N 3.26Å; N180-H184 VanDerWaalsContact O-N 3.16Å; A181-H184 CarbonylContact O-C 3.21Å; A181-H184 PolarHBondContact O-N 3.08Å; H184-R186 PolarHBondContact O-N 3.44Å; H184-R186 VanDerWaalsContact O-N 3.15Å; H184-L187 HydrophobicContact CB-CB 4.48Å; H184-L187 PolarHBondContact O-N 3.45Å; H184-L187 VanDerWaalsContact O-N 3.17Å; H184-A188 PolarHBondContact O-N 2.83Å; H184-L236 HydrophobicContact CB-CD2 4.14Å; H184-E238 IonicContact CD2-OE1 3.5Å; H184-E238 IonicContact CE1-OE1 3.55Å; H184-E238 IonicContact CE1-OE2 3.34Å; H184-E238 PolarHBondContact CE1-OE2 3.48Å; H184-E238 IonicContact NE2-OE1 2.69Å; H184-E238 PolarHBondContact NE2-OE1 3.37Å; H184-E238 IonicContact NE2-OE2 3.48Å; H184-E238 PolarHBondContact NE2-OE2 2.82Å
185	P	92.4	Very high	83.2	Confident	28 Å²	28	44.1 Å²	44.1	18%	0.182	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-34.1	-168.9	25.4	-36	0	0	0	112.7	L156 L165 A181 H183 A188 I189	L156-P185 HydrophobicContact CD1-CB 3.89Å; L156-P185 HydrophobicContact CD1-CG 4.5Å; L165-P185 HydrophobicContact CD1-CB 3.55Å; A181-P185 WeakPolarHBondContact O-CA 3.37Å; H183-P185 WeakPolarHBondContact O-CD 3.42Å; P185-A188 PolarHBondContact O-N 3.45Å; P185-I189 VanDerWaalsContact O-CG1 3.29Å; P185-I189 WeakPolarHBondContact O-CG1 3.46Å; P185-I189 PolarHBondContact O-N 3.38Å
186	R	95.4	Very high	85.1	Confident	85 Å²	85	41.3 Å²	41.3	32%	0.321	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-46.8	179	-69.9	178.4	171.2	85.5	11.8	112.6	V45 V152 E153 L156 H184 G190	V45-R186 HydrophobicContact CG2-CB 3.83Å; V152-R186 HydrophobicContact CG1-CB 3.87Å; V152-R186 HydrophobicContact CG1-CG 3.98Å; E153-R186 IonicContact OE1-CZ 2.67Å; E153-R186 IonicContact OE1-NE 3.21Å; E153-R186 PolarHBondContact OE1-NE 3.41Å; E153-R186 IonicContact OE1-NH2 2.83Å; E153-R186 PolarHBondContact OE1-NH2 2.81Å; E153-R186 VanDerWaalsContact OE1-NH2 3.09Å; E153-R186 IonicContact OE2-NH2 2.88Å; E153-R186 PolarHBondContact OE2-NH2 2.95Å; L156-R186 HydrophobicContact CD2-CG 4.33Å; H184-R186 PolarHBondContact O-N 3.44Å; H184-R186 VanDerWaalsContact O-N 3.15Å; R186-G190 PolarHBondContact O-N 3.03Å
187	L	95.4	Very high	87.2	Confident	11 Å²	11	38.4 Å²	38.4	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-71.1	-34.8	178.4	-67.6	174.6	0	0	0	111.1	V45 F167 H184 G190 S191 V213 V234 L235 L236	V45-L187 HydrophobicContact CG1-CD2 4.41Å; F167-L187 HydrophobicContact CE1-CB 4.12Å; H184-L187 HydrophobicContact CB-CB 4.48Å; H184-L187 PolarHBondContact O-N 3.45Å; H184-L187 VanDerWaalsContact O-N 3.17Å; L187-G190 PolarHBondContact O-N 2.59Å; L187-S191 PolarHBondContact O-N 2.72Å; L187-V213 HydrophobicContact CD2-CG1 4.19Å; L187-V234 HydrophobicContact CB-CG1 3.88Å; L187-V234 HydrophobicContact CD1-CG1 4.46Å; L187-L235 WeakPolarHBondContact CD1-O 3.36Å; L187-L236 HydrophobicContact CD1-CD2 3.9Å
188	A	94.6	Very high	89.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.5	-53.1	172.8	0	0	0	0	0	110.9	F167 A181 H184 P185 G190 S191 H192	F167-A188 VanDerWaalsContact CD1-CA 3.48Å; F167-A188 HydrophobicContact CD1-CB 3.92Å; F167-A188 HydrophobicContact CE1-CB 3.83Å; F167-A188 HydrophobicContact CZ-CB 4.38Å; A181-A188 HydrophobicContact CB-CB 4.23Å; H184-A188 PolarHBondContact O-N 2.83Å; P185-A188 PolarHBondContact O-N 3.45Å; A188-G190 VanDerWaalsContact C-N 3.33Å; A188-G190 PolarHBondContact O-N 2.94Å; A188-S191 WeakPolarHBondContact O-CB 3.26Å; A188-S191 PolarHBondContact O-N 3.08Å; A188-S191 VanDerWaalsContact O-N 3.13Å; A188-S191 PolarHBondContact O-OG 3.09Å; A188-H192 PolarHBondContact O-CD2 3.36Å; A188-H192 VanDerWaalsContact O-CD2 3.31Å; A188-H192 PolarHBondContact O-N 3.11Å
189	I	96.3	Very high	91.4	Very high	9 Å²	9	34.6 Å²	34.6	5%	0.046	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-42.8	175.4	-65.2	167.2	0	0	0	111.3	V152 R155 L156 I159 L165 P185 S191 H192 I193	V152-I189 HydrophobicContact CB-CG2 4.33Å; V152-I189 HydrophobicContact CG1-CB 4.22Å; V152-I189 HydrophobicContact CG1-CG2 4.25Å; V152-I189 HydrophobicContact CG2-CB 4.47Å; V152-I189 HydrophobicContact CG2-CG2 4.06Å; R155-I189 HydrophobicContact CB-CD1 4.44Å; R155-I189 HydrophobicContact CB-CG2 3.81Å; R155-I189 HydrophobicContact CG-CG2 4.39Å; L156-I189 HydrophobicContact CB-CD1 3.78Å; L156-I189 HydrophobicContact CD1-CD1 3.79Å; L156-I189 HydrophobicContact CG-CD1 4.37Å; I159-I189 HydrophobicContact CD1-CD1 3.56Å; I159-I189 HydrophobicContact CD1-CG1 4.06Å; L165-I189 HydrophobicContact CD2-CG1 4.24Å; P185-I189 VanDerWaalsContact O-CG1 3.29Å; P185-I189 WeakPolarHBondContact O-CG1 3.46Å; P185-I189 PolarHBondContact O-N 3.38Å; I189-S191 PolarHBondContact O-N 2.98Å; I189-H192 PolarHBondContact O-N 3.02Å; I189-H192 VanDerWaalsContact O-N 3.13Å; I189-I193 HydrophobicContact CG2-CD1 3.93Å; I189-I193 HydrophobicContact CG2-CG1 4.44Å; I189-I193 WeakPolarHBondContact O-CG1 3.26Å; I189-I193 PolarHBondContact O-N 3.08Å
190	G	97.9	Very high	93.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-54.7	-38.5	175.3	0	0	0	0	0	113	R186 L187 A188 I193 A194	R186-G190 PolarHBondContact O-N 3.03Å; L187-G190 PolarHBondContact O-N 2.59Å; A188-G190 VanDerWaalsContact C-N 3.33Å; A188-G190 PolarHBondContact O-N 2.94Å; G190-I193 PolarHBondContact O-N 2.98Å; G190-A194 WeakPolarHBondContact O-CB 3.33Å; G190-A194 PolarHBondContact O-N 3.36Å
191	S	97.8	Very high	95.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.4	-38.1	176.9	79.4	0	0	0	0	113.3	K168 L187 A188 I189 A194 A195 Q232 V234	K168-S191 PolarHBondContact N-OG 3.44Å; L187-S191 PolarHBondContact O-N 2.72Å; A188-S191 WeakPolarHBondContact O-CB 3.26Å; A188-S191 PolarHBondContact O-N 3.08Å; A188-S191 VanDerWaalsContact O-N 3.13Å; A188-S191 PolarHBondContact O-OG 3.09Å; I189-S191 PolarHBondContact O-N 2.98Å; S191-A194 PolarHBondContact O-N 3.16Å; S191-A195 PolarHBondContact O-N 3.44Å; S191-Q232 PolarHBondContact O-NE2 3.3Å; S191-V234 VanDerWaalsContact CB-CG2 3.44Å
192	H	98	Very high	96.1	Very high	65 Å²	65	35.9 Å²	35.9	30%	0.301	18%	0.175	S	C	.	.	H	α-helix	trans	-65.6	-42.7	173.1	-75.8	-85.2	0	0	0	111.4	S166 A188 I189 A194 A195 E196	S166-H192 PolarHBondContact O-CD2 2.93Å; S166-H192 PolarHBondContact O-NE2 3.15Å; A188-H192 PolarHBondContact O-CD2 3.36Å; A188-H192 VanDerWaalsContact O-CD2 3.31Å; A188-H192 PolarHBondContact O-N 3.11Å; I189-H192 PolarHBondContact O-N 3.02Å; I189-H192 VanDerWaalsContact O-N 3.13Å; H192-A194 VanDerWaalsContact C-N 3.33Å; H192-A194 PolarHBondContact O-N 3.07Å; H192-A195 WeakPolarHBondContact O-CB 3.45Å; H192-A195 PolarHBondContact O-N 2.83Å; H192-E196 WeakPolarHBondContact O-CG 3.33Å; H192-E196 PolarHBondContact O-N 2.93Å
193	I	98.6	Very high	96.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-45.9	175	-66.3	169.4	0	0	0	111	L47 V148 M151 V152 I189 G190 A195 E196 M197	L47-I193 HydrophobicContact CD1-CG2 3.88Å; V148-I193 HydrophobicContact CB-CD1 4.44Å; V148-I193 HydrophobicContact CB-CG2 4.41Å; V148-I193 HydrophobicContact CG1-CG2 4Å; V148-I193 HydrophobicContact CG2-CD1 4.48Å; M151-I193 HydrophobicContact CB-CD1 4.32Å; M151-I193 HydrophobicContact CE-CB 3.92Å; M151-I193 HydrophobicContact CE-CD1 3.53Å; M151-I193 HydrophobicContact CE-CG1 3.45Å; M151-I193 VanDerWaalsContact CE-CG1 3.45Å; M151-I193 HydrophobicContact CE-CG2 3.23Å; M151-I193 HydrophobicContact CG-CD1 4.18Å; V152-I193 HydrophobicContact CG2-CD1 3.69Å; I189-I193 HydrophobicContact CG2-CD1 3.93Å; I189-I193 HydrophobicContact CG2-CG1 4.44Å; I189-I193 WeakPolarHBondContact O-CG1 3.26Å; I189-I193 PolarHBondContact O-N 3.08Å; G190-I193 PolarHBondContact O-N 2.98Å; I193-A195 VanDerWaalsContact C-N 3.28Å; I193-A195 PolarHBondContact O-N 3.44Å; I193-E196 PolarHBondContact O-N 3.11Å; I193-M197 HydrophobicContact CG2-CE 3.64Å; I193-M197 HydrophobicContact CG2-SD 4.14Å; I193-M197 WeakPolarHBondContact O-CG 3.25Å; I193-M197 PolarHBondContact O-N 3.46Å
194	A	98.8	Very high	97.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-40.8	177.5	0	0	0	0	0	111.8	L47 G190 S191 H192 M197 R198 A211 V213	L47-A194 HydrophobicContact CD1-CB 4.08Å; L47-A194 HydrophobicContact CD2-CB 4.12Å; G190-A194 WeakPolarHBondContact O-CB 3.33Å; G190-A194 PolarHBondContact O-N 3.36Å; S191-A194 PolarHBondContact O-N 3.16Å; H192-A194 VanDerWaalsContact C-N 3.33Å; H192-A194 PolarHBondContact O-N 3.07Å; A194-M197 PolarHBondContact O-N 3.08Å; A194-R198 WeakPolarHBondContact O-CG 3.43Å; A194-R198 PolarHBondContact O-N 2.93Å; A194-A211 HydrophobicContact CB-CB 4.24Å; A194-V213 HydrophobicContact CB-CG2 3.93Å
195	A	98.8	Very high	97.6	Very high	7 Å²	7	36.2 Å²	36.2	6%	0.058	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-44.5	177.4	0	0	0	0	0	112.1	K168 S191 H192 I193 M197 R198 D199	K168-A195 HydrophobicContact CB-CB 4.35Å; K168-A195 HydrophobicContact CG-CB 3.52Å; S191-A195 PolarHBondContact O-N 3.44Å; H192-A195 WeakPolarHBondContact O-CB 3.45Å; H192-A195 PolarHBondContact O-N 2.83Å; I193-A195 VanDerWaalsContact C-N 3.28Å; I193-A195 PolarHBondContact O-N 3.44Å; A195-M197 VanDerWaalsContact C-N 3.33Å; A195-M197 PolarHBondContact O-N 3.39Å; A195-R198 PolarHBondContact O-N 3.28Å; A195-D199 WeakPolarHBondContact O-CB 3.37Å; A195-D199 VanDerWaalsContact O-CG 3.28Å; A195-D199 PolarHBondContact O-N 3.07Å
196	E	98.8	Very high	97.9	Very high	75 Å²	75	37 Å²	37	35%	0.35	19%	0.191	S	C	.	.	H	α-helix	trans	-58.5	-44	175.4	-70.6	167.6	-156.3	0	0	111.9	R155 H192 I193 D199 A200	R155-E196 IonicContact CZ-OE1 3.89Å; R155-E196 IonicContact CZ-OE2 3.42Å; R155-E196 IonicContact NH1-OE1 2.71Å; R155-E196 PolarHBondContact NH1-OE1 2.92Å; R155-E196 IonicContact NH1-OE2 3.18Å; R155-E196 PolarHBondContact NH1-OE2 3.01Å; R155-E196 IonicContact NH2-OE1 2.74Å; R155-E196 PolarHBondContact NH2-OE1 2.82Å; R155-E196 IonicContact NH2-OE2 2.7Å; R155-E196 PolarHBondContact NH2-OE2 2.84Å; H192-E196 WeakPolarHBondContact O-CG 3.33Å; H192-E196 PolarHBondContact O-N 2.93Å; I193-E196 PolarHBondContact O-N 3.11Å; E196-D199 PolarHBondContact O-N 2.95Å; E196-A200 WeakPolarHBondContact O-CB 3.42Å; E196-A200 PolarHBondContact O-N 3.03Å
197	M	98.8	Very high	98.1	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.5	-42.2	177.3	-71	178.1	-179.1	0	0	111.9	L47 F49 L129 F132 V146 V148 M151 I193 A194 A195 D199 A200 I201	L47-M197 HydrophobicContact CD1-SD 3.89Å; F49-M197 HydrophobicContact CE1-CB 3.78Å; F49-M197 HydrophobicContact CE2-SD 3.88Å; F49-M197 HydrophobicContact CZ-CB 3.52Å; F49-M197 HydrophobicContact CZ-CG 4.19Å; F49-M197 HydrophobicContact CZ-SD 3.58Å; F49-M197 VanDerWaalsContact CZ-SD 3.58Å; L129-M197 HydrophobicContact CD2-CB 4.07Å; L129-M197 HydrophobicContact CD2-CG 4.23Å; L129-M197 HydrophobicContact CD2-SD 3.97Å; F132-M197 HydrophobicContact CB-CE 3.38Å; F132-M197 HydrophobicContact CD1-CE 4.05Å; F132-M197 HydrophobicContact CD1-CG 3.94Å; F132-M197 HydrophobicContact CD2-CG 4.17Å; F132-M197 HydrophobicContact CE1-CG 4.11Å; F132-M197 HydrophobicContact CE2-CG 4.34Å; F132-M197 HydrophobicContact CG-CE 3.83Å; F132-M197 HydrophobicContact CG-CG 3.98Å; F132-M197 HydrophobicContact CZ-CG 4.3Å; V146-M197 HydrophobicContact CG1-CE 4.31Å; V148-M197 HydrophobicContact CG1-CE 4.01Å; M151-M197 HydrophobicContact CE-CE 4.37Å; I193-M197 HydrophobicContact CG2-CE 3.64Å; I193-M197 HydrophobicContact CG2-SD 4.14Å; I193-M197 WeakPolarHBondContact O-CG 3.25Å; I193-M197 PolarHBondContact O-N 3.46Å; A194-M197 PolarHBondContact O-N 3.08Å; A195-M197 VanDerWaalsContact C-N 3.33Å; A195-M197 PolarHBondContact O-N 3.39Å; M197-D199 VanDerWaalsContact C-N 3.35Å; M197-A200 PolarHBondContact O-N 3.24Å; M197-I201 VanDerWaalsContact O-CG1 3.32Å; M197-I201 WeakPolarHBondContact O-CG1 3.41Å; M197-I201 PolarHBondContact O-N 2.86Å
198	R	98.8	Very high	98.2	Very high	33 Å²	33	34 Å²	34	13%	0.125	18%	0.182	C	C	.	.	H	α-helix	trans	-60.9	-43.9	173.7	-76.2	175.9	2.2	109.2	0.3	111.7	F49 A194 A195 A200 I201 R202 G209 A211 N230 Q231	F49-R198 HydrophobicContact CD1-CG 4.07Å; F49-R198 HydrophobicContact CE1-CG 3.82Å; A194-R198 WeakPolarHBondContact O-CG 3.43Å; A194-R198 PolarHBondContact O-N 2.93Å; A195-R198 PolarHBondContact O-N 3.28Å; R198-A200 VanDerWaalsContact C-N 3.33Å; R198-I201 PolarHBondContact O-N 2.82Å; R198-R202 WeakPolarHBondContact O-CB 3.41Å; R198-R202 PolarHBondContact O-N 3.42Å; R198-G209 PolarHBondContact NH1-O 3.04Å; R198-A211 HydrophobicContact CG-CB 4.18Å; R198-N230 PolarHBondContact NH1-O 3.19Å; R198-N230 PolarHBondContact NH1-OD1 3.46Å; R198-N230 PolarHBondContact NH2-O 3.46Å; R198-Q231 PolarHBondContact NH1-O 3.22Å
199	D	98.8	Very high	98.4	Very high	66 Å²	66	34.3 Å²	34.3	35%	0.353	19%	0.186	S	C	.	.	H	α-helix	trans	-64.8	-39.3	178.3	-73.9	-15.6	0	0	0	111.2	A195 E196 M197 R202 S203	A195-D199 WeakPolarHBondContact O-CB 3.37Å; A195-D199 VanDerWaalsContact O-CG 3.28Å; A195-D199 PolarHBondContact O-N 3.07Å; E196-D199 PolarHBondContact O-N 2.95Å; M197-D199 VanDerWaalsContact C-N 3.35Å; D199-R202 PolarHBondContact O-N 2.85Å; D199-R202 IonicContact OD1-CZ 2.71Å; D199-R202 IonicContact OD1-NH1 2.99Å; D199-R202 PolarHBondContact OD1-NH1 2.81Å; D199-R202 IonicContact OD1-NH2 2.79Å; D199-R202 PolarHBondContact OD1-NH2 3.34Å; D199-S203 WeakPolarHBondContact O-CB 3.49Å; D199-S203 PolarHBondContact O-N 3.14Å; D199-S203 PolarHBondContact O-OG 2.82Å
200	A	98.8	Very high	98.5	Very high	12 Å²	12	33.9 Å²	33.9	10%	0.099	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-42.3	173.9	0	0	0	0	0	112.6	L128 F132 E196 M197 R198 R202 S203 K204	L128-A200 HydrophobicContact CD2-CB 4.35Å; F132-A200 HydrophobicContact CE2-CB 4Å; F132-A200 HydrophobicContact CZ-CB 3.75Å; E196-A200 WeakPolarHBondContact O-CB 3.42Å; E196-A200 PolarHBondContact O-N 3.03Å; M197-A200 PolarHBondContact O-N 3.24Å; R198-A200 VanDerWaalsContact C-N 3.33Å; A200-R202 VanDerWaalsContact C-N 3.32Å; A200-R202 PolarHBondContact O-N 2.73Å; A200-S203 PolarHBondContact O-N 3.33Å; A200-S203 PolarHBondContact O-OG 3.18Å; A200-K204 VanDerWaalsContact O-CB 3.26Å; A200-K204 WeakPolarHBondContact O-CB 3.34Å; A200-K204 WeakPolarHBondContact O-CG 3.42Å; A200-K204 PolarHBondContact O-N 3.38Å
201	I	98.7	Very high	98.5	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-58.8	-46.3	174.1	-71.5	165.4	0	0	0	109.8	F49 L51 V125 L128 L129 M197 R198 L205 G206 L207	F49-I201 HydrophobicContact CD1-CD1 4.26Å; L51-I201 HydrophobicContact CD2-CG2 4.22Å; V125-I201 HydrophobicContact CG1-CD1 4.26Å; L128-I201 HydrophobicContact CD2-CB 4.44Å; L128-I201 HydrophobicContact CD2-CG1 3.9Å; L129-I201 HydrophobicContact CD2-CD1 4.15Å; M197-I201 VanDerWaalsContact O-CG1 3.32Å; M197-I201 WeakPolarHBondContact O-CG1 3.41Å; M197-I201 PolarHBondContact O-N 2.86Å; R198-I201 PolarHBondContact O-N 2.82Å; I201-L205 WeakPolarHBondContact O-CA 3.47Å; I201-L205 WeakPolarHBondContact O-CB 3.29Å; I201-L205 PolarHBondContact O-N 3.46Å; I201-G206 PolarHBondContact O-N 3.38Å; I201-L207 HydrophobicContact CG2-CB 3.68Å; I201-L207 HydrophobicContact CG2-CD1 4.49Å
202	R	98.6	Very high	98.6	Very high	101 Å²	101	33.9 Å²	33.9	38%	0.381	18%	0.184	S	C	.	.	H	α-helix	trans	-64.4	-49	178.6	-172.7	173.1	68.7	-111.5	-1	112.6	R198 D199 A200 G206 L207 T208	R198-R202 WeakPolarHBondContact O-CB 3.41Å; R198-R202 PolarHBondContact O-N 3.42Å; D199-R202 PolarHBondContact O-N 2.85Å; D199-R202 IonicContact OD1-CZ 2.71Å; D199-R202 IonicContact OD1-NH1 2.99Å; D199-R202 PolarHBondContact OD1-NH1 2.81Å; D199-R202 IonicContact OD1-NH2 2.79Å; D199-R202 PolarHBondContact OD1-NH2 3.34Å; A200-R202 VanDerWaalsContact C-N 3.32Å; A200-R202 PolarHBondContact O-N 2.73Å; R202-G206 VanDerWaalsContact O-CA 3.23Å; R202-G206 WeakPolarHBondContact O-CA 3.4Å; R202-G206 PolarHBondContact O-N 3.11Å; R202-L207 WeakPolarHBondContact CA-O 3.49Å; R202-L207 WeakPolarHBondContact CB-O 3.43Å; R202-L207 PolarHBondContact N-O 3.21Å; R202-T208 HydrophobicContact CG-CG2 4.48Å
203	S	98.5	Very high	98.6	Very high	97 Å²	97	30.8 Å²	30.8	68%	0.678	17%	0.169	S	C	*	.	H	α-helix	trans	-71.5	-35.6	-174.8	71.1	0	0	0	0	112.9	D199 A200	D199-S203 WeakPolarHBondContact O-CB 3.49Å; D199-S203 PolarHBondContact O-N 3.14Å; D199-S203 PolarHBondContact O-OG 2.82Å; A200-S203 PolarHBondContact O-N 3.33Å; A200-S203 PolarHBondContact O-OG 3.18Å
204	K	98.4	Very high	98.6	Very high	138 Å²	138	30.8 Å²	30.8	60%	0.6	17%	0.169	S	C	*	.	H	α-helix	trans	-92	-35	-175.3	-64.1	-178.1	-179.6	-177.6	0	113.4	L128 A200	L128-K204 HydrophobicContact CD1-CD 3.6Å; L128-K204 HydrophobicContact CD2-CB 4.39Å; L128-K204 HydrophobicContact CD2-CD 4.23Å; A200-K204 VanDerWaalsContact O-CB 3.26Å; A200-K204 WeakPolarHBondContact O-CB 3.34Å; A200-K204 WeakPolarHBondContact O-CG 3.42Å; A200-K204 PolarHBondContact O-N 3.38Å
205	L	98.3	Very high	98.5	Very high	30 Å²	30	32 Å²	32	16%	0.157	18%	0.177	C	C	.	.	H	α-helix	trans	-115.2	-8	-172.4	-52.4	178.4	0	0	0	113.1	M121 Q124 V125 L128 I201 L207	M121-L205 HydrophobicContact SD-CB 4.13Å; Q124-L205 HydrophobicContact CB-CD1 4.25Å; Q124-L205 HydrophobicContact CB-CD2 4.05Å; V125-L205 HydrophobicContact CB-CD1 4.27Å; V125-L205 HydrophobicContact CG2-CD1 3.56Å; L128-L205 HydrophobicContact CD2-CD1 3.99Å; L128-L205 HydrophobicContact CD2-CG 4.25Å; I201-L205 WeakPolarHBondContact O-CA 3.47Å; I201-L205 WeakPolarHBondContact O-CB 3.29Å; I201-L205 PolarHBondContact O-N 3.46Å; L205-L207 HydrophobicContact CB-CD1 4.12Å; L205-L207 HydrophobicContact CB-CG 4.28Å; L205-L207 HydrophobicContact CD1-CD1 4.48Å; L205-L207 PolarHBondContact O-N 2.79Å
206	G	98.1	Very high	98.5	Very high	44 Å²	44	32.2 Å²	32.2	45%	0.454	18%	0.177	S	C	.	.			trans	71.4	11.2	-177.8	0	0	0	0	0	114.1	I201 R202	I201-G206 PolarHBondContact O-N 3.38Å; R202-G206 VanDerWaalsContact O-CA 3.23Å; R202-G206 WeakPolarHBondContact O-CA 3.4Å; R202-G206 PolarHBondContact O-N 3.11Å
207	L	98.7	Very high	98.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.164	C	C	.	.			trans	-95.5	148.6	-177.7	-66.8	168.4	0	0	0	111.8	L51 F54 Q57 V58 I61 M121 V125 I201 R202 L205	L51-L207 HydrophobicContact CD1-CD1 4.08Å; L51-L207 HydrophobicContact CD2-CB 4.49Å; F54-L207 HydrophobicContact CD2-CD2 4.48Å; F54-L207 HydrophobicContact CE2-CD1 4.42Å; F54-L207 HydrophobicContact CE2-CD2 4.44Å; Q57-L207 HydrophobicContact CB-CD2 4.31Å; Q57-L207 HydrophobicContact CG-CD2 3.94Å; V58-L207 HydrophobicContact CG2-CD2 4.46Å; I61-L207 HydrophobicContact CD1-CD2 3.58Å; I61-L207 HydrophobicContact CD1-CG 4.02Å; M121-L207 HydrophobicContact CG-CD1 3.62Å; M121-L207 HydrophobicContact CG-CD2 4.32Å; M121-L207 HydrophobicContact CG-CG 4.36Å; M121-L207 HydrophobicContact SD-CD1 3.61Å; M121-L207 HydrophobicContact SD-CG 4.2Å; V125-L207 HydrophobicContact CG2-CD1 3.4Å; I201-L207 HydrophobicContact CG2-CB 3.68Å; I201-L207 HydrophobicContact CG2-CD1 4.49Å; R202-L207 WeakPolarHBondContact CA-O 3.49Å; R202-L207 WeakPolarHBondContact CB-O 3.43Å; R202-L207 PolarHBondContact N-O 3.21Å; L205-L207 HydrophobicContact CB-CD1 4.12Å; L205-L207 HydrophobicContact CB-CG 4.28Å; L205-L207 HydrophobicContact CD1-CD1 4.48Å; L205-L207 PolarHBondContact O-N 2.79Å
208	T	98.6	Very high	98.4	Very high	32 Å²	32	29.8 Å²	29.8	20%	0.196	17%	0.165	C	C	.	.			trans	-116.4	156.2	167.9	72.6	0	0	0	0	110	D52 Q57 R202	D52-T208 PolarHBondContact N-O 2.89Å; D52-T208 PolarHBondContact OD2-OG1 3.47Å; Q57-T208 PolarHBondContact NE2-OG1 2.96Å; Q57-T208 PolarHBondContact OE1-O 2.91Å; R202-T208 HydrophobicContact CG-CG2 4.48Å
209	G	98.1	Very high	98.4	Very high	8 Å²	8	28.3 Å²	28.3	8%	0.082	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	166.4	178.2	0	0	0	0	0	111.2	D50 D52 R198	D50-G209 CarbonylContact O-C 3.54Å; D50-G209 VanDerWaalsContact O-CA 3.24Å; D50-G209 WeakPolarHBondContact O-CA 3.38Å; D52-G209 WeakPolarHBondContact OD2-CA 3.35Å; D52-G209 PolarHBondContact OD2-N 2.64Å; R198-G209 PolarHBondContact NH1-O 3.04Å
210	C	98.7	Very high	98.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	153.2	175	-57.5	0	0	0	0	110.7	F49 D50 S224 N230 Q231	F49-C210 WeakPolarHBondContact CA-O 3.47Å; D50-C210 PolarHBondContact N-O 3.26Å; D50-C210 PolarHBondContact O-N 3Å; C210-S224 WeakPolarHBondContact CB-O 3.49Å; C210-N230 PolarHBondContact SG-N 3.16Å; C210-N230 VanDerWaalsContact SG-N 3.42Å; C210-Q231 CarbonylContact C-O 3.59Å; C210-Q231 WeakPolarHBondContact CA-O 3.45Å; C210-Q231 WeakPolarHBondContact CB-O 3.36Å
211	A	98.8	Very high	98.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.2	172.2	0	0	0	0	0	112.3	H48 F49 A194 R198 Q231 Q232 T233	H48-A211 CarbonylContact O-C 3.55Å; H48-A211 WeakPolarHBondContact O-CA 3.26Å; F49-A211 HydrophobicContact CD1-CB 3.99Å; F49-A211 HydrophobicContact CE1-CB 4.04Å; A194-A211 HydrophobicContact CB-CB 4.24Å; R198-A211 HydrophobicContact CG-CB 4.18Å; A211-Q231 PolarHBondContact N-O 3.21Å; A211-Q231 VanDerWaalsContact N-O 3.07Å; A211-Q232 HydrophobicContact CB-CB 3.94Å; A211-Q232 CarbonylContact O-C 3.48Å; A211-Q232 WeakPolarHBondContact O-CA 3.47Å; A211-Q232 WeakPolarHBondContact O-CB 3.5Å; A211-T233 PolarHBondContact O-N 3.46Å
212	G	98.7	Very high	98.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.5	172.5	0	0	0	0	0	110.4	L47 H48 A220 T233	L47-G212 CarbonylContact C-O 3.6Å; L47-G212 WeakPolarHBondContact CA-O 3.48Å; H48-G212 PolarHBondContact N-O 3.44Å; H48-G212 PolarHBondContact O-N 3.24Å; G212-A220 WeakPolarHBondContact CA-O 3.16Å; G212-T233 WeakPolarHBondContact CA-O 3.16Å
213	V	98.7	Very high	98.3	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.7	-179.5	-171.2	0	0	0	0	108.5	V45 L47 L187 A194 T233 V234 L235	V45-V213 HydrophobicContact CG1-CG1 4.13Å; L47-V213 HydrophobicContact CD2-CB 4.2Å; L47-V213 HydrophobicContact CD2-CG1 3.8Å; L47-V213 HydrophobicContact CD2-CG2 3.85Å; L187-V213 HydrophobicContact CD2-CG1 4.19Å; A194-V213 HydrophobicContact CB-CG2 3.93Å; V213-T233 PolarHBondContact N-O 3.18Å; V213-V234 HydrophobicContact CB-CB 4.41Å; V213-V234 HydrophobicContact CB-CG1 4.33Å; V213-V234 HydrophobicContact CB-CG2 4.07Å; V213-V234 HydrophobicContact CG2-CG2 4.24Å; V213-V234 WeakPolarHBondContact O-CA 3.39Å; V213-L235 PolarHBondContact O-N 3.4Å
214	A	98.1	Very high	98.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	-173.5	-178.8	0	0	0	0	0	112	I46 L219 A220 L235	I46-A214 PolarHBondContact N-O 2.88Å; I46-A214 PolarHBondContact O-N 3.15Å; A214-L219 HydrophobicContact CB-CB 3.61Å; A214-A220 HydrophobicContact CB-CB 4.07Å; A214-L235 HydrophobicContact CB-CB 4.22Å
215	T	97.3	Very high	98.1	Very high	25 Å²	25	13.7 Å²	13.7	15%	0.153	9%	0.093	C	C	.	.	S	Bend	trans	-89	-10.3	-177.3	53.2	0	0	0	0	114.4	R44	R44-T215 WeakPolarHBondContact O-CA 3.42Å
216	N	97.8	Very high	97.9	Very high	11 Å²	11	14.6 Å²	14.6	6%	0.059	10%	0.1	C	C	.	.	S	Bend	trans	-153.5	171.3	176	64.6	52.9	0	0	0	112.2	L218 L219 A220 G301 D303	N216-L218 PolarHBondContact OD1-N 3.23Å; N216-L219 WeakPolarHBondContact ND2-CD1 3.49Å; N216-L219 WeakPolarHBondContact OD1-CB 3.47Å; N216-L219 VanDerWaalsContact OD1-CG 3.29Å; N216-L219 WeakPolarHBondContact OD1-CG 3.29Å; N216-L219 PolarHBondContact OD1-N 2.94Å; N216-A220 WeakPolarHBondContact O-CB 3.33Å; N216-A220 PolarHBondContact O-N 3.46Å; N216-G301 PolarHBondContact ND2-O 3.26Å; N216-D303 HydrophobicContact CB-CB 4.13Å; N216-D303 VanDerWaalsContact CB-O 3.29Å; N216-D303 WeakPolarHBondContact CB-O 3.47Å
217	K	98.1	Very high	97.7	Very high	20 Å²	20	16 Å²	16	9%	0.087	9%	0.093	C	C	.	.	H	α-helix	trans	-64.3	-47.5	-175.9	-69.1	-163.9	-61.5	-171.6	0	112.6	I46 E137 F145 L219 A220 K221 S305 A306 V307	I46-K217 HydrophobicContact CG2-CG 4.08Å; E137-K217 IonicContact OE1-NZ 3.13Å; E137-K217 PolarHBondContact OE1-NZ 3.35Å; E137-K217 IonicContact OE2-NZ 3.88Å; E137-K217 PolarHBondContact OE2-NZ 2.92Å; F145-K217 HydrophobicContact CB-CD 4.22Å; F145-K217 HydrophobicContact CB-CG 4.5Å; F145-K217 HydrophobicContact CD1-CB 3.9Å; F145-K217 HydrophobicContact CD1-CD 4.07Å; F145-K217 HydrophobicContact CD1-CG 3.79Å; F145-K217 HydrophobicContact CD2-CD 4.08Å; F145-K217 HydrophobicContact CE1-CB 3.71Å; F145-K217 HydrophobicContact CE1-CD 4.46Å; F145-K217 HydrophobicContact CE1-CG 4.14Å; F145-K217 VanDerWaalsContact CE1-O 3.3Å; F145-K217 WeakPolarHBondContact CE1-O 3.48Å; F145-K217 HydrophobicContact CE2-CD 4.47Å; F145-K217 HydrophobicContact CG-CD 3.85Å; F145-K217 HydrophobicContact CG-CG 4.08Å; F145-K217 HydrophobicContact CZ-CB 4.2Å; K217-L219 PolarHBondContact O-N 2.99Å; K217-A220 PolarHBondContact O-N 3.2Å; K217-K221 WeakPolarHBondContact O-CB 3.33Å; K217-K221 PolarHBondContact O-N 3.25Å; K217-S305 WeakPolarHBondContact CE-OG 3.24Å; K217-A306 WeakPolarHBondContact CE-O 3.48Å; K217-A306 PolarHBondContact NZ-O 3.4Å; K217-V307 HydrophobicContact CD-CG2 3.93Å; K217-V307 HydrophobicContact CG-CG2 3.97Å
218	L	98.1	Very high	97.5	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-49.1	-55.9	176.2	170.2	65.5	0	0	0	111.7	N216 K221 L222 V253 P254 L298 D303	N216-L218 PolarHBondContact OD1-N 3.23Å; L218-K221 PolarHBondContact O-N 3.45Å; L218-L222 HydrophobicContact CD1-CD1 3.96Å; L218-L222 HydrophobicContact CD1-CG 4.3Å; L218-L222 HydrophobicContact CG-CD1 4.19Å; L218-L222 WeakPolarHBondContact O-CG 3.24Å; L218-L222 PolarHBondContact O-N 3.08Å; L218-V253 HydrophobicContact CD1-CG1 4.37Å; L218-P254 HydrophobicContact CD1-CB 3.91Å; L218-P254 HydrophobicContact CD1-CG 3.81Å; L218-L298 HydrophobicContact CB-CD2 4.4Å; L218-L298 HydrophobicContact CD1-CD2 4.43Å; L218-L298 HydrophobicContact CD2-CB 4.28Å; L218-L298 HydrophobicContact CD2-CD2 3.81Å; L218-L298 VanDerWaalsContact CD2-O 3.31Å; L218-L298 WeakPolarHBondContact CD2-O 3.37Å; L218-L298 HydrophobicContact CG-CD2 4.44Å; L218-D303 HydrophobicContact CB-CB 3.72Å; L218-D303 PolarHBondContact N-OD2 3.07Å
219	L	98.3	Very high	97.5	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-69	-38.7	-175.5	-66.4	178.6	0	0	0	112.5	A214 N216 K217 K221 L222 V223 L235 V240 I243 M244 G301	A214-L219 HydrophobicContact CB-CB 3.61Å; N216-L219 WeakPolarHBondContact ND2-CD1 3.49Å; N216-L219 WeakPolarHBondContact OD1-CB 3.47Å; N216-L219 VanDerWaalsContact OD1-CG 3.29Å; N216-L219 WeakPolarHBondContact OD1-CG 3.29Å; N216-L219 PolarHBondContact OD1-N 2.94Å; K217-L219 PolarHBondContact O-N 2.99Å; L219-K221 VanDerWaalsContact C-N 3.3Å; L219-K221 PolarHBondContact O-N 3.16Å; L219-L222 PolarHBondContact O-N 2.85Å; L219-V223 WeakPolarHBondContact O-CG1 3.35Å; L219-V223 PolarHBondContact O-N 2.84Å; L219-L235 HydrophobicContact CB-CD2 3.78Å; L219-L235 HydrophobicContact CD1-CD2 4.03Å; L219-L235 HydrophobicContact CD2-CD2 3.79Å; L219-L235 HydrophobicContact CG-CD2 4.07Å; L219-V240 HydrophobicContact CD1-CG1 4.24Å; L219-V240 HydrophobicContact CD1-CG2 3.77Å; L219-V240 HydrophobicContact CD2-CG1 4.12Å; L219-I243 HydrophobicContact CD2-CG2 4.29Å; L219-M244 HydrophobicContact CD2-SD 4.33Å; L219-G301 WeakPolarHBondContact CD1-O 3.32Å
220	A	98.6	Very high	97.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.6	-41.2	176.1	0	0	0	0	0	110.9	I46 H48 G212 A214 N216 K217 S224	I46-A220 HydrophobicContact CB-CB 4.41Å; I46-A220 HydrophobicContact CG2-CB 4.1Å; H48-A220 HydrophobicContact CB-CB 3.78Å; G212-A220 WeakPolarHBondContact CA-O 3.16Å; A214-A220 HydrophobicContact CB-CB 4.07Å; N216-A220 WeakPolarHBondContact O-CB 3.33Å; N216-A220 PolarHBondContact O-N 3.46Å; K217-A220 PolarHBondContact O-N 3.2Å; A220-S224 WeakPolarHBondContact O-CB 3.5Å; A220-S224 PolarHBondContact O-N 3.49Å; A220-S224 VanDerWaalsContact O-N 3.16Å
221	K	98.6	Very high	97.5	Very high	46 Å²	46	26.1 Å²	26.1	20%	0.2	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-41.7	175.7	179.8	168.4	-178.6	62.9	0	113.1	L139 E143 F145 K217 L218 L219 S224 P254	L139-K221 HydrophobicContact CD2-CD 4.27Å; E143-K221 IonicContact OE1-NZ 2.72Å; E143-K221 PolarHBondContact OE1-NZ 3.22Å; E143-K221 IonicContact OE2-NZ 3.62Å; E143-K221 PolarHBondContact OE2-NZ 2.91Å; F145-K221 HydrophobicContact CE1-CB 3.97Å; F145-K221 HydrophobicContact CZ-CB 3.97Å; F145-K221 HydrophobicContact CZ-CD 4.17Å; K217-K221 WeakPolarHBondContact O-CB 3.33Å; K217-K221 PolarHBondContact O-N 3.25Å; L218-K221 PolarHBondContact O-N 3.45Å; L219-K221 VanDerWaalsContact C-N 3.3Å; L219-K221 PolarHBondContact O-N 3.16Å; K221-S224 PolarHBondContact O-OG 3.38Å; K221-P254 HydrophobicContact CD-CB 4.21Å; K221-P254 HydrophobicContact CD-CG 3.97Å; K221-P254 HydrophobicContact CG-CG 4.28Å
222	L	97.8	Very high	97.4	Very high	27 Å²	27	26.3 Å²	26.3	14%	0.141	14%	0.143	C	C	.	.	H	α-helix	trans	-65	-49.3	178.5	-72.2	176.6	0	0	0	111.1	L218 L219 S224 G225 I243 M244 L247 P254	L218-L222 HydrophobicContact CD1-CD1 3.96Å; L218-L222 HydrophobicContact CD1-CG 4.3Å; L218-L222 HydrophobicContact CG-CD1 4.19Å; L218-L222 WeakPolarHBondContact O-CG 3.24Å; L218-L222 PolarHBondContact O-N 3.08Å; L219-L222 PolarHBondContact O-N 2.85Å; L222-S224 VanDerWaalsContact C-N 3.34Å; L222-S224 PolarHBondContact O-N 3.44Å; L222-G225 PolarHBondContact O-N 2.83Å; L222-I243 HydrophobicContact CB-CD1 3.89Å; L222-I243 HydrophobicContact CB-CG1 4.43Å; L222-M244 HydrophobicContact CD1-SD 3.56Å; L222-M244 VanDerWaalsContact CD1-SD 3.56Å; L222-L247 HydrophobicContact CD1-CD1 4.28Å; L222-L247 HydrophobicContact CD2-CD1 4.43Å; L222-L247 HydrophobicContact CD2-CD2 3.93Å; L222-P254 HydrophobicContact CD2-CG 4.07Å; L222-P254 HydrophobicContact CG-CG 4.39Å
223	V	97.8	Very high	97.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-72.2	-26.7	-173.5	81.5	0	0	0	0	113	F172 L219 G225 T226 T233 L235 I243	F172-V223 HydrophobicContact CB-CG2 3.97Å; F172-V223 HydrophobicContact CD2-CG2 4.27Å; F172-V223 HydrophobicContact CG-CG2 4.33Å; L219-V223 WeakPolarHBondContact O-CG1 3.35Å; L219-V223 PolarHBondContact O-N 2.84Å; V223-G225 PolarHBondContact O-N 3.05Å; V223-T226 WeakPolarHBondContact O-CB 3.31Å; V223-T226 PolarHBondContact O-N 3.44Å; V223-T226 PolarHBondContact O-OG1 3.43Å; V223-T233 HydrophobicContact CG2-CG2 3.56Å; V223-T233 WeakPolarHBondContact O-CB 3.33Å; V223-T233 PolarHBondContact O-OG1 3.14Å; V223-L235 HydrophobicContact CB-CB 4Å; V223-L235 HydrophobicContact CG1-CB 4.12Å; V223-L235 HydrophobicContact CG2-CB 3.84Å; V223-L235 HydrophobicContact CG2-CD1 4.4Å; V223-I243 HydrophobicContact CB-CD1 3.8Å; V223-I243 HydrophobicContact CG2-CD1 4.03Å
224	S	97.9	Very high	97.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-27.8	178.2	66	0	0	0	0	113.3	H48 C210 A220 K221 L222	H48-S224 PolarHBondContact CE1-OG 3.13Å; H48-S224 WeakPolarHBondContact ND1-CB 3.43Å; H48-S224 PolarHBondContact ND1-OG 3.29Å; C210-S224 WeakPolarHBondContact CB-O 3.49Å; A220-S224 WeakPolarHBondContact O-CB 3.5Å; A220-S224 PolarHBondContact O-N 3.49Å; A220-S224 VanDerWaalsContact O-N 3.16Å; K221-S224 PolarHBondContact O-OG 3.38Å; L222-S224 VanDerWaalsContact C-N 3.34Å; L222-S224 PolarHBondContact O-N 3.44Å
225	G	94.3	Very high	97.2	Very high	37 Å²	37	26.5 Å²	26.5	38%	0.381	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.2	-179.3	0	0	0	0	0	114.8	L222 V223 F227	L222-G225 PolarHBondContact O-N 2.83Å; V223-G225 PolarHBondContact O-N 3.05Å; G225-F227 PolarHBondContact O-N 3.47Å
226	T	94.7	Very high	97.1	Very high	50 Å²	50	25.3 Å²	25.3	31%	0.307	14%	0.137	S	C	.	.	S	Bend	trans	-64.2	-44.3	-171.8	-47	0	0	0	0	112.7	F172 V223	F172-T226 HydrophobicContact CD2-CG2 3.89Å; F172-T226 HydrophobicContact CE2-CG2 4.03Å; V223-T226 WeakPolarHBondContact O-CB 3.31Å; V223-T226 PolarHBondContact O-N 3.44Å; V223-T226 PolarHBondContact O-OG1 3.43Å
227	F	95	Very high	96.7	Very high	72 Å²	72	29.9 Å²	29.9	32%	0.316	16%	0.157	S	C	.	.	S	Bend	trans	-123.4	109.3	-178.6	-65.2	-84.6	0	0	0	108.5	N170 G225 Q231 T233	N170-F227 HydrophobicContact CB-CD2 3.79Å; N170-F227 HydrophobicContact CB-CE2 3.81Å; N170-F227 HydrophobicContact CB-CG 4.47Å; N170-F227 HydrophobicContact CB-CZ 4.49Å; N170-F227 WeakPolarHBondContact ND2-CG 3.24Å; G225-F227 PolarHBondContact O-N 3.47Å; F227-Q231 HydrophobicContact CB-CB 3.9Å; F227-Q231 WeakPolarHBondContact O-CB 3.45Å; F227-T233 HydrophobicContact CD2-CG2 3.96Å; F227-T233 WeakPolarHBondContact CD2-OG1 3.35Å; F227-T233 HydrophobicContact CE2-CG2 4.09Å
228	K	94.7	Very high	96.4	Very high	71 Å²	71	33.5 Å²	33.5	31%	0.309	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.2	155.3	175.9	-51.4	-166.1	77.8	157.3	0	109.5	D50	D50-K228 IonicContact OD1-NZ 2.81Å; D50-K228 PolarHBondContact OD1-NZ 2.94Å; D50-K228 IonicContact OD2-NZ 3.34Å; D50-K228 PolarHBondContact OD2-NZ 2.88Å
229	P	97.2	Very high	96.1	Very high	56 Å²	56	34.1 Å²	34.1	36%	0.364	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	cis	-77.7	168.6	-8.8	28.1	-31.6	0	0	0	114.1	D52 Y84 Q231	D52-P229 WeakPolarHBondContact OD1-CA 3.31Å; D52-P229 WeakPolarHBondContact OD1-CB 3.38Å; Y84-P229 HydrophobicContact CD1-CB 4.29Å; Y84-P229 HydrophobicContact CD1-CG 4.09Å; Y84-P229 HydrophobicContact CD2-CB 4.16Å; Y84-P229 HydrophobicContact CD2-CG 4.5Å; Y84-P229 HydrophobicContact CE1-CB 3.81Å; Y84-P229 HydrophobicContact CE1-CG 4.01Å; Y84-P229 HydrophobicContact CE2-CB 3.68Å; Y84-P229 HydrophobicContact CE2-CG 4.43Å; Y84-P229 HydrophobicContact CG-CB 4.44Å; Y84-P229 HydrophobicContact CG-CG 4.34Å; Y84-P229 VanDerWaalsContact CZ-CB 3.47Å; P229-Q231 WeakPolarHBondContact O-CG 3.39Å; P229-Q231 PolarHBondContact O-N 2.81Å
230	N	98.1	Very high	95.9	Very high	53 Å²	53	34.8 Å²	34.8	28%	0.283	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	36.3	163.4	-169.4	29.8	0	0	0	115.5	D52 R198 C210	D52-N230 PolarHBondContact OD1-N 3.31Å; D52-N230 WeakPolarHBondContact OD2-CA 3.17Å; D52-N230 WeakPolarHBondContact OD2-CB 3.28Å; D52-N230 PolarHBondContact OD2-N 3.08Å; R198-N230 PolarHBondContact NH1-O 3.19Å; R198-N230 PolarHBondContact NH1-OD1 3.46Å; R198-N230 PolarHBondContact NH2-O 3.46Å; C210-N230 PolarHBondContact SG-N 3.16Å; C210-N230 VanDerWaalsContact SG-N 3.42Å
231	Q	98.3	Very high	95.7	Very high	73 Å²	73	38.9 Å²	38.9	34%	0.341	21%	0.211	S	C	.	.			trans	-120.4	174.8	177.2	-74.4	-179.5	70.4	0	0	111.7	N170 R198 C210 A211 F227 P229	N170-Q231 PolarHBondContact ND2-OE1 2.87Å; R198-Q231 PolarHBondContact NH1-O 3.22Å; C210-Q231 CarbonylContact C-O 3.59Å; C210-Q231 WeakPolarHBondContact CA-O 3.45Å; C210-Q231 WeakPolarHBondContact CB-O 3.36Å; A211-Q231 PolarHBondContact N-O 3.21Å; A211-Q231 VanDerWaalsContact N-O 3.07Å; F227-Q231 HydrophobicContact CB-CB 3.9Å; F227-Q231 WeakPolarHBondContact O-CB 3.45Å; P229-Q231 WeakPolarHBondContact O-CG 3.39Å; P229-Q231 PolarHBondContact O-N 2.81Å
232	Q	98.3	Very high	95.5	Very high	5 Å²	5	39.7 Å²	39.7	2%	0.023	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.5	174.5	66.7	-177.6	63.5	0	0	110.9	K168 N170 S191 A211	K168-Q232 PolarHBondContact O-NE2 3.32Å; N170-Q232 WeakPolarHBondContact CB-O 3.39Å; N170-Q232 PolarHBondContact N-O 3.47Å; N170-Q232 PolarHBondContact ND2-O 3.33Å; S191-Q232 PolarHBondContact O-NE2 3.3Å; A211-Q232 HydrophobicContact CB-CB 3.94Å; A211-Q232 CarbonylContact O-C 3.48Å; A211-Q232 WeakPolarHBondContact O-CA 3.47Å; A211-Q232 WeakPolarHBondContact O-CB 3.5Å
233	T	98	Very high	95.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	133.5	-173.5	-38.2	0	0	0	0	110.6	N170 F172 A211 G212 V213 V223 F227	N170-T233 HydrophobicContact CB-CG2 4.13Å; N170-T233 CarbonylContact O-C 3.57Å; N170-T233 VanDerWaalsContact O-CA 3.31Å; N170-T233 WeakPolarHBondContact O-CA 3.42Å; F172-T233 HydrophobicContact CB-CG2 4.06Å; A211-T233 PolarHBondContact O-N 3.46Å; G212-T233 WeakPolarHBondContact CA-O 3.16Å; V213-T233 PolarHBondContact N-O 3.18Å; V223-T233 HydrophobicContact CG2-CG2 3.56Å; V223-T233 WeakPolarHBondContact O-CB 3.33Å; V223-T233 PolarHBondContact O-OG1 3.14Å; F227-T233 HydrophobicContact CD2-CG2 3.96Å; F227-T233 WeakPolarHBondContact CD2-OG1 3.35Å; F227-T233 HydrophobicContact CE2-CG2 4.09Å
234	V	97.4	Very high	95.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	133.5	172.9	-174.2	0	0	0	0	109.2	F167 N170 F172 L187 S191 V213 L236	F167-V234 HydrophobicContact CD1-CB 4.34Å; F167-V234 HydrophobicContact CD1-CG1 4.15Å; F167-V234 HydrophobicContact CD1-CG2 4Å; F167-V234 HydrophobicContact CE1-CG1 3.93Å; N170-V234 PolarHBondContact O-N 2.83Å; F172-V234 PolarHBondContact N-O 3.28Å; L187-V234 HydrophobicContact CB-CG1 3.88Å; L187-V234 HydrophobicContact CD1-CG1 4.46Å; S191-V234 VanDerWaalsContact CB-CG2 3.44Å; V213-V234 HydrophobicContact CB-CB 4.41Å; V213-V234 HydrophobicContact CB-CG1 4.33Å; V213-V234 HydrophobicContact CB-CG2 4.07Å; V213-V234 HydrophobicContact CG2-CG2 4.24Å; V213-V234 WeakPolarHBondContact O-CA 3.39Å; V234-L236 HydrophobicContact CG1-CD2 4.12Å
235	L	95.8	Very high	95.1	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-103.2	122	170.5	-174.4	70.8	0	0	0	110.1	F172 L187 V213 A214 L219 V223 N239 V240 I243	F172-L235 HydrophobicContact CB-CD1 3.95Å; F172-L235 HydrophobicContact CD1-CD1 3.6Å; F172-L235 HydrophobicContact CE1-CD1 4.36Å; F172-L235 HydrophobicContact CG-CD1 3.9Å; L187-L235 WeakPolarHBondContact CD1-O 3.36Å; V213-L235 PolarHBondContact O-N 3.4Å; A214-L235 HydrophobicContact CB-CB 4.22Å; L219-L235 HydrophobicContact CB-CD2 3.78Å; L219-L235 HydrophobicContact CD1-CD2 4.03Å; L219-L235 HydrophobicContact CD2-CD2 3.79Å; L219-L235 HydrophobicContact CG-CD2 4.07Å; V223-L235 HydrophobicContact CB-CB 4Å; V223-L235 HydrophobicContact CG1-CB 4.12Å; V223-L235 HydrophobicContact CG2-CB 3.84Å; V223-L235 HydrophobicContact CG2-CD1 4.4Å; L235-N239 HydrophobicContact CD1-CB 4.01Å; L235-V240 HydrophobicContact CD2-CG2 4.24Å; L235-I243 HydrophobicContact CD1-CB 4.16Å; L235-I243 HydrophobicContact CD1-CD1 4.23Å; L235-I243 HydrophobicContact CD1-CG2 3.94Å; L235-I243 HydrophobicContact CD2-CD1 4.45Å; L235-I243 HydrophobicContact CD2-CG2 3.8Å
236	L	93.9	Very high	95.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-86.7	156.4	172.9	-51.9	-177.3	0	0	0	111	F167 V171 N180 H184 L187 V234 E238 N239	F167-L236 HydrophobicContact CE1-CD2 4.14Å; F167-L236 HydrophobicContact CZ-CD2 3.73Å; V171-L236 HydrophobicContact CG1-CD1 3.85Å; V171-L236 HydrophobicContact CG1-CG 3.96Å; N180-L236 HydrophobicContact CB-CD1 4.38Å; H184-L236 HydrophobicContact CB-CD2 4.14Å; L187-L236 HydrophobicContact CD1-CD2 3.9Å; V234-L236 HydrophobicContact CG1-CD2 4.12Å; L236-E238 VanDerWaalsContact C-N 3.26Å; L236-E238 HydrophobicContact CB-CG 4.09Å; L236-E238 WeakPolarHBondContact CB-OE2 3.41Å; L236-E238 PolarHBondContact O-N 2.87Å; L236-N239 PolarHBondContact O-N 3.25Å; L236-N239 VanDerWaalsContact O-N 3.09Å
237	Q	90.4	Very high	95.1	Very high	106 Å²	106	43.8 Å²	43.8	50%	0.495	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-63.8	-33.8	-173.1	-172.3	64	24	0	0	112.3	N239 V240	Q237-N239 PolarHBondContact O-N 3.35Å; Q237-V240 VanDerWaalsContact O-CG2 3.31Å; Q237-V240 WeakPolarHBondContact O-CG2 3.24Å; Q237-V240 PolarHBondContact O-N 2.99Å
238	E	90.6	Very high	94.9	Very high	97 Å²	97	44.5 Å²	44.5	45%	0.453	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-64.4	-25.3	176.5	52.9	-93.3	-132.2	0	0	113.4	H184 L236	H184-E238 IonicContact CD2-OE1 3.5Å; H184-E238 IonicContact CE1-OE1 3.55Å; H184-E238 IonicContact CE1-OE2 3.34Å; H184-E238 PolarHBondContact CE1-OE2 3.48Å; H184-E238 IonicContact NE2-OE1 2.69Å; H184-E238 PolarHBondContact NE2-OE1 3.37Å; H184-E238 IonicContact NE2-OE2 3.48Å; H184-E238 PolarHBondContact NE2-OE2 2.82Å; L236-E238 VanDerWaalsContact C-N 3.26Å; L236-E238 HydrophobicContact CB-CG 4.09Å; L236-E238 WeakPolarHBondContact CB-OE2 3.41Å; L236-E238 PolarHBondContact O-N 2.87Å
239	N	92.5	Very high	94.8	Very high	17 Å²	17	41.9 Å²	41.9	9%	0.091	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-99.3	9.3	-178.1	-57.7	113.6	0	0	0	113.8	F172 L235 L236 Q237 S241 D242 I243	F172-N239 HydrophobicContact CD1-CB 3.88Å; F172-N239 HydrophobicContact CE1-CB 4.37Å; L235-N239 HydrophobicContact CD1-CB 4.01Å; L236-N239 PolarHBondContact O-N 3.25Å; L236-N239 VanDerWaalsContact O-N 3.09Å; Q237-N239 PolarHBondContact O-N 3.35Å; N239-S241 VanDerWaalsContact C-N 3.32Å; N239-S241 PolarHBondContact O-N 3.39Å; N239-D242 PolarHBondContact ND2-OD2 3.29Å; N239-D242 WeakPolarHBondContact O-CB 3.34Å; N239-D242 PolarHBondContact O-N 3.49Å; N239-I243 PolarHBondContact O-N 3.36Å; N239-I243 VanDerWaalsContact O-N 3.11Å
240	V	94.4	Very high	94.7	Very high	15 Å²	15	39.5 Å²	39.5	9%	0.091	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-41.2	178.1	172.8	0	0	0	0	111.3	L219 L235 Q237 D242 I243 M244	L219-V240 HydrophobicContact CD1-CG1 4.24Å; L219-V240 HydrophobicContact CD1-CG2 3.77Å; L219-V240 HydrophobicContact CD2-CG1 4.12Å; L235-V240 HydrophobicContact CD2-CG2 4.24Å; Q237-V240 VanDerWaalsContact O-CG2 3.31Å; Q237-V240 WeakPolarHBondContact O-CG2 3.24Å; Q237-V240 PolarHBondContact O-N 2.99Å; V240-D242 VanDerWaalsContact C-N 3.3Å; V240-D242 PolarHBondContact O-N 2.91Å; V240-I243 WeakPolarHBondContact O-CG2 3.43Å; V240-M244 HydrophobicContact CG1-CG 4.49Å; V240-M244 WeakPolarHBondContact O-CB 3.41Å; V240-M244 VanDerWaalsContact O-CG 3.23Å; V240-M244 WeakPolarHBondContact O-CG 3.2Å; V240-M244 PolarHBondContact O-N 2.98Å
241	S	93.9	Very high	94.5	Very high	87 Å²	87	41.7 Å²	41.7	61%	0.608	25%	0.245	S	C	*	.	H	α-helix	trans	-65.1	-36.7	176.9	-170.1	0	0	0	0	111.9	N239 G245	N239-S241 VanDerWaalsContact C-N 3.32Å; N239-S241 PolarHBondContact O-N 3.39Å; S241-G245 PolarHBondContact O-N 3.45Å
242	D	94.3	Very high	94.3	Very high	62 Å²	62	41.1 Å²	41.1	33%	0.332	24%	0.242	S	C	.	.	H	α-helix	trans	-65.1	-53	-178.8	-59.7	-23.1	0	0	0	110.6	F172 N173 N239 V240 M244 G245 C246	F172-D242 HydrophobicContact CE1-CB 4Å; N173-D242 PolarHBondContact ND2-OD2 2.72Å; N239-D242 PolarHBondContact ND2-OD2 3.29Å; N239-D242 WeakPolarHBondContact O-CB 3.34Å; N239-D242 PolarHBondContact O-N 3.49Å; V240-D242 VanDerWaalsContact C-N 3.3Å; V240-D242 PolarHBondContact O-N 2.91Å; D242-M244 VanDerWaalsContact C-N 3.31Å; D242-M244 PolarHBondContact O-N 3.03Å; D242-G245 CarbonylContact O-C 3.51Å; D242-G245 WeakPolarHBondContact O-CA 3.28Å; D242-G245 PolarHBondContact O-N 3.2Å; D242-C246 PolarHBondContact O-N 3.27Å; D242-C246 PolarHBondContact O-SG 3.05Å
243	I	95.1	Very high	94.2	Very high	8 Å²	8	41 Å²	41	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-36.3	-178.4	-166	169.5	0	0	0	112.2	F172 L219 L222 V223 L235 N239 V240 G245 C246	F172-I243 HydrophobicContact CD1-CB 4.42Å; F172-I243 HydrophobicContact CD2-CD1 4.49Å; F172-I243 HydrophobicContact CE1-CB 3.79Å; F172-I243 HydrophobicContact CE1-CG1 4.45Å; F172-I243 HydrophobicContact CE2-CB 4.45Å; F172-I243 HydrophobicContact CE2-CD1 4.35Å; F172-I243 HydrophobicContact CE2-CG1 4.24Å; F172-I243 HydrophobicContact CZ-CB 3.81Å; F172-I243 HydrophobicContact CZ-CG1 4.04Å; L219-I243 HydrophobicContact CD2-CG2 4.29Å; L222-I243 HydrophobicContact CB-CD1 3.89Å; L222-I243 HydrophobicContact CB-CG1 4.43Å; V223-I243 HydrophobicContact CB-CD1 3.8Å; V223-I243 HydrophobicContact CG2-CD1 4.03Å; L235-I243 HydrophobicContact CD1-CB 4.16Å; L235-I243 HydrophobicContact CD1-CD1 4.23Å; L235-I243 HydrophobicContact CD1-CG2 3.94Å; L235-I243 HydrophobicContact CD2-CD1 4.45Å; L235-I243 HydrophobicContact CD2-CG2 3.8Å; N239-I243 PolarHBondContact O-N 3.36Å; N239-I243 VanDerWaalsContact O-N 3.11Å; V240-I243 WeakPolarHBondContact O-CG2 3.43Å; I243-G245 VanDerWaalsContact C-N 3.32Å; I243-C246 PolarHBondContact O-N 3.38Å
244	M	96.3	Very high	94.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-69	-33.1	175.2	-66.9	-55.6	-58.3	0	0	111.7	L219 L222 V240 D242 L247 V253 V272 L298	L219-M244 HydrophobicContact CD2-SD 4.33Å; L222-M244 HydrophobicContact CD1-SD 3.56Å; L222-M244 VanDerWaalsContact CD1-SD 3.56Å; V240-M244 HydrophobicContact CG1-CG 4.49Å; V240-M244 WeakPolarHBondContact O-CB 3.41Å; V240-M244 VanDerWaalsContact O-CG 3.23Å; V240-M244 WeakPolarHBondContact O-CG 3.2Å; V240-M244 PolarHBondContact O-N 2.98Å; D242-M244 VanDerWaalsContact C-N 3.31Å; D242-M244 PolarHBondContact O-N 3.03Å; M244-L247 HydrophobicContact CE-CD1 3.86Å; M244-L247 HydrophobicContact SD-CD1 4.26Å; M244-V253 HydrophobicContact CE-CG2 4.33Å; M244-V272 HydrophobicContact CE-CG1 4.11Å; M244-L298 WeakPolarHBondContact CE-O 3.47Å
245	G	93.7	Very high	93.9	Very high	63 Å²	63	44.8 Å²	44.8	65%	0.649	27%	0.273	S	S	*	.	H	α-helix	trans	-71.5	-26.9	175.1	0	0	0	0	0	113.9	S241 D242 I243 L247	S241-G245 PolarHBondContact O-N 3.45Å; D242-G245 CarbonylContact O-C 3.51Å; D242-G245 WeakPolarHBondContact O-CA 3.28Å; D242-G245 PolarHBondContact O-N 3.2Å; I243-G245 VanDerWaalsContact C-N 3.32Å; G245-L247 PolarHBondContact O-N 2.89Å
246	C	93.9	Very high	93.8	Very high	95 Å²	95	45 Å²	45	64%	0.642	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-9.7	175.9	-67.1	0	0	0	0	114.1	D242 I243 S248	D242-C246 PolarHBondContact O-N 3.27Å; D242-C246 PolarHBondContact O-SG 3.05Å; I243-C246 PolarHBondContact O-N 3.38Å; C246-S248 PolarHBondContact O-N 3.28Å
247	L	94.6	Very high	93.8	Very high	33 Å²	33	46.9 Å²	46.9	17%	0.173	29%	0.294	C	S	.	.			trans	-74.8	117.3	-178.4	-59.4	-178.9	0	0	0	110.8	L222 M244 G245 G249 K252 V253 V272	L222-L247 HydrophobicContact CD1-CD1 4.28Å; L222-L247 HydrophobicContact CD2-CD1 4.43Å; L222-L247 HydrophobicContact CD2-CD2 3.93Å; M244-L247 HydrophobicContact CE-CD1 3.86Å; M244-L247 HydrophobicContact SD-CD1 4.26Å; G245-L247 PolarHBondContact O-N 2.89Å; L247-G249 PolarHBondContact O-N 3.32Å; L247-G249 VanDerWaalsContact O-N 3.14Å; L247-K252 HydrophobicContact CB-CB 4.24Å; L247-K252 HydrophobicContact CD2-CB 4.11Å; L247-V253 HydrophobicContact CD1-CG2 3.68Å; L247-V272 HydrophobicContact CB-CG2 3.93Å; L247-V272 HydrophobicContact CD1-CG2 4.18Å
248	S	91.9	Very high	93.8	Very high	87 Å²	87	47.2 Å²	47.2	61%	0.608	30%	0.296	S	S	*	.	S	Bend	trans	-66.4	-14.1	-177	55.1	0	0	0	0	115	C246	C246-S248 PolarHBondContact O-N 3.28Å
249	G	92.8	Very high	93.8	Very high	16 Å²	16	48.4 Å²	48.4	17%	0.165	30%	0.301	C	S	.	.	S	Bend	trans	-173	170	176.8	0	0	0	0	0	114.3	L247 R251 K252	L247-G249 PolarHBondContact O-N 3.32Å; L247-G249 VanDerWaalsContact O-N 3.14Å; G249-R251 VanDerWaalsContact C-N 3.3Å; G249-R251 PolarHBondContact O-N 3.13Å; G249-K252 WeakPolarHBondContact O-CB 3.16Å; G249-K252 PolarHBondContact O-N 3.46Å
250	L	93.9	Very high	93.9	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-58.6	-36.4	-175.4	-70.3	173	0	0	0	113.9	K252 V253 V256 L264 L269 S271 L275	L250-K252 PolarHBondContact O-N 2.87Å; L250-V253 WeakPolarHBondContact O-CB 3.17Å; L250-V253 PolarHBondContact O-N 3.41Å; L250-V253 VanDerWaalsContact O-N 3.15Å; L250-V256 HydrophobicContact CB-CG1 4.31Å; L250-V256 VanDerWaalsContact O-CB 3.29Å; L250-V256 WeakPolarHBondContact O-CB 3.47Å; L250-V256 WeakPolarHBondContact O-CG1 3.22Å; L250-L264 HydrophobicContact CD1-CB 3.8Å; L250-L264 HydrophobicContact CD1-CD1 4.01Å; L250-L269 HydrophobicContact CD1-CB 4.27Å; L250-L269 VanDerWaalsContact CD1-O 3.24Å; L250-L269 WeakPolarHBondContact CD1-O 3.48Å; L250-S271 WeakPolarHBondContact CD2-O 3.5Å; L250-L275 HydrophobicContact CD2-CB 3.91Å; L250-L275 HydrophobicContact CD2-CD2 3.89Å
251	R	95.3	Very high	93.9	Very high	98 Å²	98	48.6 Å²	48.6	37%	0.37	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-64.9	-20.2	178.4	-73.1	-172.7	61.9	-118.9	-11.3	113.4	E9 D11 G249 V253 A261	E9-R251 IonicContact OE2-CZ 3.54Å; E9-R251 IonicContact OE2-NH1 2.74Å; E9-R251 PolarHBondContact OE2-NH1 3.35Å; D11-R251 IonicContact OD2-CZ 2.87Å; D11-R251 IonicContact OD2-NH1 3.59Å; D11-R251 PolarHBondContact OD2-NH1 3.26Å; D11-R251 VanDerWaalsContact OD2-NH1 3.15Å; D11-R251 IonicContact OD2-NH2 2.74Å; G249-R251 VanDerWaalsContact C-N 3.3Å; G249-R251 PolarHBondContact O-N 3.13Å; R251-V253 PolarHBondContact O-N 2.85Å; R251-A261 HydrophobicContact CG-CB 3.67Å
252	K	94.2	Very high	93.8	Very high	62 Å²	62	50.4 Å²	50.4	27%	0.27	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-77	-9.1	177.4	-59.3	-60.3	-167.2	-177.9	0	112.7	D11 L247 G249 L250 P254	D11-K252 IonicContact OD1-NZ 3.52Å; D11-K252 PolarHBondContact OD1-NZ 3.36Å; L247-K252 HydrophobicContact CB-CB 4.24Å; L247-K252 HydrophobicContact CD2-CB 4.11Å; G249-K252 WeakPolarHBondContact O-CB 3.16Å; G249-K252 PolarHBondContact O-N 3.46Å; L250-K252 PolarHBondContact O-N 2.87Å; K252-P254 VanDerWaalsContact O-CD 3.22Å; K252-P254 WeakPolarHBondContact O-CD 3.49Å
253	V	95.7	Very high	93.8	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.006	30%	0.3	C	S	.	.	S	Bend	trans	-83.1	113.4	172.1	-177.5	0	0	0	0	109.5	L218 M244 L247 L250 R251 G255 V256 V272 L298	L218-V253 HydrophobicContact CD1-CG1 4.37Å; M244-V253 HydrophobicContact CE-CG2 4.33Å; L247-V253 HydrophobicContact CD1-CG2 3.68Å; L250-V253 WeakPolarHBondContact O-CB 3.17Å; L250-V253 PolarHBondContact O-N 3.41Å; L250-V253 VanDerWaalsContact O-N 3.15Å; R251-V253 PolarHBondContact O-N 2.85Å; V253-G255 PolarHBondContact O-N 3.41Å; V253-G255 VanDerWaalsContact O-N 3.15Å; V253-V256 HydrophobicContact CB-CB 4.45Å; V253-V256 HydrophobicContact CB-CG2 3.87Å; V253-V256 HydrophobicContact CG1-CG2 4.11Å; V253-V256 WeakPolarHBondContact O-CB 3.13Å; V253-V256 PolarHBondContact O-N 3.08Å; V253-V272 HydrophobicContact CG2-CG2 3.72Å; V253-L298 HydrophobicContact CG1-CB 3.97Å
254	P	95.4	Very high	93.8	Very high	38 Å²	38	51 Å²	51	25%	0.247	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	122.3	172.4	-28.7	34.4	0	0	0	112.1	L218 K221 L222 K252	L218-P254 HydrophobicContact CD1-CB 3.91Å; L218-P254 HydrophobicContact CD1-CG 3.81Å; K221-P254 HydrophobicContact CD-CB 4.21Å; K221-P254 HydrophobicContact CD-CG 3.97Å; K221-P254 HydrophobicContact CG-CG 4.28Å; L222-P254 HydrophobicContact CD2-CG 4.07Å; L222-P254 HydrophobicContact CG-CG 4.39Å; K252-P254 VanDerWaalsContact O-CD 3.22Å; K252-P254 WeakPolarHBondContact O-CD 3.49Å
255	G	92.7	Very high	93.7	Very high	42 Å²	42	56 Å²	56	43%	0.433	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.3	-9.3	-174.7	0	0	0	0	0	114.8	V253	V253-G255 PolarHBondContact O-N 3.41Å; V253-G255 VanDerWaalsContact O-N 3.15Å
256	V	95	Very high	93.7	Very high	8 Å²	8	57 Å²	57	5%	0.048	32%	0.323	C	S	.	.			trans	-102.3	94.3	171.4	-173.5	0	0	0	0	110.1	L250 V253 T260 A261 L264 L295	L250-V256 HydrophobicContact CB-CG1 4.31Å; L250-V256 VanDerWaalsContact O-CB 3.29Å; L250-V256 WeakPolarHBondContact O-CB 3.47Å; L250-V256 WeakPolarHBondContact O-CG1 3.22Å; V253-V256 HydrophobicContact CB-CB 4.45Å; V253-V256 HydrophobicContact CB-CG2 3.87Å; V253-V256 HydrophobicContact CG1-CG2 4.11Å; V253-V256 WeakPolarHBondContact O-CB 3.13Å; V253-V256 PolarHBondContact O-N 3.08Å; V256-T260 HydrophobicContact CG1-CG2 4.3Å; V256-A261 HydrophobicContact CG1-CB 4.12Å; V256-L264 HydrophobicContact CG1-CD1 4.12Å; V256-L295 HydrophobicContact CG2-CD2 3.66Å
257	G	93.1	Very high	93.7	Very high	40 Å²	40	55.7 Å²	55.7	41%	0.412	31%	0.31	S	S	.	.			trans	-81.9	173.6	175.1	0	0	0	0	0	113.4	Q259 T260 A261	G257-Q259 PolarHBondContact O-N 2.91Å; G257-T260 PolarHBondContact O-N 3.02Å; G257-T260 VanDerWaalsContact O-N 3.08Å; G257-A261 PolarHBondContact O-N 3.3Å
258	H	90.6	Very high	93.7	Very high	113 Å²	113	56.8 Å²	56.8	52%	0.523	33%	0.329	S	S	.	.	H	α-helix	trans	-50.3	-49.5	-179	179.2	81.2	0	0	0	113.3	T260 A261 K262	H258-T260 PolarHBondContact O-N 2.69Å; H258-A261 PolarHBondContact O-N 3.26Å; H258-K262 WeakPolarHBondContact O-CB 3.3Å; H258-K262 PolarHBondContact O-N 3.34Å
259	Q	90.7	Very high	93.9	Very high	122 Å²	122	53.4 Å²	53.4	57%	0.57	30%	0.304	S	S	*	.	H	α-helix	trans	-64.4	-40.4	-179.8	-171.5	62.7	24.9	0	0	112.3	G257 R263	G257-Q259 PolarHBondContact O-N 2.91Å; Q259-R263 VanDerWaalsContact O-CG 3.26Å; Q259-R263 WeakPolarHBondContact O-CG 3.26Å; Q259-R263 PolarHBondContact O-N 3.06Å
260	T	94.2	Very high	93.9	Very high	34 Å²	34	57.3 Å²	57.3	21%	0.209	32%	0.324	C	S	.	.	H	α-helix	trans	-66.6	-44.5	177.4	-53.4	0	0	0	0	110.7	V256 G257 H258 K262 R263 L264 L295	V256-T260 HydrophobicContact CG1-CG2 4.3Å; G257-T260 PolarHBondContact O-N 3.02Å; G257-T260 VanDerWaalsContact O-N 3.08Å; H258-T260 PolarHBondContact O-N 2.69Å; T260-K262 PolarHBondContact O-N 3.39Å; T260-R263 PolarHBondContact O-N 2.95Å; T260-L264 HydrophobicContact CG2-CD1 4.12Å; T260-L264 HydrophobicContact CG2-CG 4.48Å; T260-L264 WeakPolarHBondContact O-CG 3.33Å; T260-L264 PolarHBondContact O-N 2.79Å; T260-L295 HydrophobicContact CG2-CD1 3.72Å; T260-L295 HydrophobicContact CG2-CD2 4.15Å
261	A	94.1	Very high	94	Very high	2 Å²	2	58.8 Å²	58.8	2%	0.017	34%	0.335	C	S	.	.	H	α-helix	trans	-58.7	-45.5	176.3	0	0	0	0	0	111.5	R251 V256 G257 H258 R263 L264 Q265	R251-A261 HydrophobicContact CG-CB 3.67Å; V256-A261 HydrophobicContact CG1-CB 4.12Å; G257-A261 PolarHBondContact O-N 3.3Å; H258-A261 PolarHBondContact O-N 3.26Å; A261-R263 VanDerWaalsContact C-N 3.29Å; A261-R263 PolarHBondContact O-N 3.47Å; A261-L264 WeakPolarHBondContact O-CB 3.22Å; A261-L264 PolarHBondContact O-N 2.64Å; A261-L264 VanDerWaalsContact O-N 3.15Å; A261-Q265 WeakPolarHBondContact O-CB 3.47Å; A261-Q265 VanDerWaalsContact O-CG 3.3Å; A261-Q265 WeakPolarHBondContact O-CG 3.45Å; A261-Q265 PolarHBondContact O-N 2.91Å
262	K	92.6	Very high	94	Very high	125 Å²	125	54.5 Å²	54.5	54%	0.543	32%	0.32	S	S	.	.	H	α-helix	trans	-58	-40.1	176.3	-173.9	174.5	-176.8	172	0	112.7	H258 T260 Q265 A266	H258-K262 WeakPolarHBondContact O-CB 3.3Å; H258-K262 PolarHBondContact O-N 3.34Å; T260-K262 PolarHBondContact O-N 3.39Å; K262-Q265 PolarHBondContact O-N 2.98Å; K262-A266 PolarHBondContact O-N 2.71Å
263	R	94.3	Very high	94.1	Very high	84 Å²	84	58.1 Å²	58.1	32%	0.317	34%	0.335	S	S	.	.	H	α-helix	trans	-70.8	-37.5	177.1	-65.4	175.4	72.7	-169.1	6.6	112.4	Q259 T260 A261 A266 L267 E286 L287	Q259-R263 VanDerWaalsContact O-CG 3.26Å; Q259-R263 WeakPolarHBondContact O-CG 3.26Å; Q259-R263 PolarHBondContact O-N 3.06Å; T260-R263 PolarHBondContact O-N 2.95Å; A261-R263 VanDerWaalsContact C-N 3.29Å; A261-R263 PolarHBondContact O-N 3.47Å; R263-A266 PolarHBondContact O-N 3.29Å; R263-L267 PolarHBondContact O-N 2.96Å; R263-E286 IonicContact CZ-OE1 3.39Å; R263-E286 IonicContact NE-OE1 2.71Å; R263-E286 PolarHBondContact NE-OE1 2.93Å; R263-E286 PolarHBondContact NH2-O 3.35Å; R263-E286 IonicContact NH2-OE1 3.27Å; R263-E286 PolarHBondContact NH2-OE1 3Å; R263-L287 HydrophobicContact CB-CD2 3.83Å; R263-L287 VanDerWaalsContact CZ-CD2 3.43Å
264	L	95.3	Very high	94.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-40.9	173.2	-68.8	169.9	0	0	0	111.5	L250 V256 T260 A261 A266 L267 G268 L269 L275 L283 L287	L250-L264 HydrophobicContact CD1-CB 3.8Å; L250-L264 HydrophobicContact CD1-CD1 4.01Å; V256-L264 HydrophobicContact CG1-CD1 4.12Å; T260-L264 HydrophobicContact CG2-CD1 4.12Å; T260-L264 HydrophobicContact CG2-CG 4.48Å; T260-L264 WeakPolarHBondContact O-CG 3.33Å; T260-L264 PolarHBondContact O-N 2.79Å; A261-L264 WeakPolarHBondContact O-CB 3.22Å; A261-L264 PolarHBondContact O-N 2.64Å; A261-L264 VanDerWaalsContact O-N 3.15Å; L264-A266 VanDerWaalsContact C-N 3.31Å; L264-A266 PolarHBondContact O-N 2.75Å; L264-L267 CarbonylContact O-C 3.52Å; L264-L267 WeakPolarHBondContact O-CA 3.4Å; L264-L267 WeakPolarHBondContact O-CB 3.15Å; L264-L267 PolarHBondContact O-N 3.15Å; L264-G268 PolarHBondContact O-N 2.97Å; L264-L269 HydrophobicContact CB-CB 4.33Å; L264-L269 HydrophobicContact CD2-CD1 3.81Å; L264-L269 WeakPolarHBondContact O-CB 3.33Å; L264-L269 PolarHBondContact O-N 3.36Å; L264-L275 HydrophobicContact CD1-CD2 4.42Å; L264-L275 HydrophobicContact CD2-CD1 3.97Å; L264-L283 HydrophobicContact CD2-CD2 3.83Å; L264-L287 HydrophobicContact CD2-CD1 3.68Å; L264-L287 HydrophobicContact CG-CD1 4.31Å
265	Q	94.2	Very high	94.1	Very high	105 Å²	105	58.7 Å²	58.7	49%	0.491	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-36.4	174.4	-73.3	168.5	-10.4	0	0	112	A261 K262 L267 G268 L269	A261-Q265 WeakPolarHBondContact O-CB 3.47Å; A261-Q265 VanDerWaalsContact O-CG 3.3Å; A261-Q265 WeakPolarHBondContact O-CG 3.45Å; A261-Q265 PolarHBondContact O-N 2.91Å; K262-Q265 PolarHBondContact O-N 2.98Å; Q265-L267 PolarHBondContact O-N 3.04Å; Q265-G268 WeakPolarHBondContact O-CA 3.35Å; Q265-G268 PolarHBondContact O-N 2.67Å; Q265-L269 WeakPolarHBondContact CA-O 3.46Å
266	A	92.8	Very high	94.2	Very high	86 Å²	86	58.9 Å²	58.9	71%	0.711	33%	0.326	S	S	*	.	H	α-helix	trans	-63.6	-22.4	173.3	0	0	0	0	0	113.1	K262 R263 L264 G268	K262-A266 PolarHBondContact O-N 2.71Å; R263-A266 PolarHBondContact O-N 3.29Å; L264-A266 VanDerWaalsContact C-N 3.31Å; L264-A266 PolarHBondContact O-N 2.75Å; A266-G268 VanDerWaalsContact C-N 3.31Å
267	L	93.9	Very high	94.2	Very high	67 Å²	67	64.3 Å²	64.3	35%	0.351	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	3.3	169.6	-62.1	177.1	0	0	0	113.4	R263 L264 Q265 L269 L283 E286	R263-L267 PolarHBondContact O-N 2.96Å; L264-L267 CarbonylContact O-C 3.52Å; L264-L267 WeakPolarHBondContact O-CA 3.4Å; L264-L267 WeakPolarHBondContact O-CB 3.15Å; L264-L267 PolarHBondContact O-N 3.15Å; Q265-L267 PolarHBondContact O-N 3.04Å; L267-L269 HydrophobicContact CB-CD1 4.34Å; L267-L269 HydrophobicContact CB-CG 4.17Å; L267-L269 HydrophobicContact CD1-CD1 4.45Å; L267-L283 HydrophobicContact CD1-CD2 4.29Å; L267-E286 HydrophobicContact CD1-CB 3.77Å; L267-E286 HydrophobicContact CD1-CG 3.83Å; L267-E286 HydrophobicContact CD2-CB 4.13Å; L267-E286 HydrophobicContact CD2-CG 4.19Å; L267-E286 HydrophobicContact CG-CB 4.3Å; L267-E286 HydrophobicContact CG-CG 4.05Å
268	G	95	Very high	94.3	Very high	56 Å²	56	63.1 Å²	63.1	58%	0.577	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	13.6	-176.2	0	0	0	0	0	114.7	L264 Q265 A266	L264-G268 PolarHBondContact O-N 2.97Å; Q265-G268 WeakPolarHBondContact O-CA 3.35Å; Q265-G268 PolarHBondContact O-N 2.67Å; A266-G268 VanDerWaalsContact C-N 3.31Å
269	L	96.2	Very high	94.5	Very high	16 Å²	16	61.4 Å²	61.4	8%	0.084	34%	0.338	C	S	.	.			trans	-92.2	120.5	179.6	-50.7	175	0	0	0	109.9	L250 L264 Q265 L267 D274 L275 C278 L283	L250-L269 HydrophobicContact CD1-CB 4.27Å; L250-L269 VanDerWaalsContact CD1-O 3.24Å; L250-L269 WeakPolarHBondContact CD1-O 3.48Å; L264-L269 HydrophobicContact CB-CB 4.33Å; L264-L269 HydrophobicContact CD2-CD1 3.81Å; L264-L269 WeakPolarHBondContact O-CB 3.33Å; L264-L269 PolarHBondContact O-N 3.36Å; Q265-L269 WeakPolarHBondContact CA-O 3.46Å; L267-L269 HydrophobicContact CB-CD1 4.34Å; L267-L269 HydrophobicContact CB-CG 4.17Å; L267-L269 HydrophobicContact CD1-CD1 4.45Å; L269-D274 HydrophobicContact CB-CB 4.22Å; L269-D274 HydrophobicContact CD2-CB 3.76Å; L269-L275 HydrophobicContact CD1-CD1 4.31Å; L269-C278 HydrophobicContact CD1-CB 4.12Å; L269-C278 HydrophobicContact CD2-CB 4.03Å; L269-L283 HydrophobicContact CD1-CD2 3.76Å
270	V	93.6	Very high	94.7	Very high	98 Å²	98	58.8 Å²	58.8	59%	0.594	33%	0.328	S	S	*	.			trans	-120.8	-24.9	-177.3	-63.7	0	0	0	0	113.1	D274	V270-D274 WeakPolarHBondContact CG2-OD2 3.48Å; V270-D274 PolarHBondContact N-OD2 2.92Å; V270-D274 VanDerWaalsContact N-OD2 3.15Å
271	S	95.2	Very high	94.8	Very high	38 Å²	38	59.7 Å²	59.7	27%	0.266	34%	0.343	S	S	.	.	S	Bend	trans	-116.4	162.2	-179.5	75.2	0	0	0	0	113.2	L250 K273 D274 L275	L250-S271 WeakPolarHBondContact CD2-O 3.5Å; S271-K273 PolarHBondContact O-N 3.29Å; S271-K273 PolarHBondContact OG-N 3.48Å; S271-D274 WeakPolarHBondContact CB-OD2 3.43Å; S271-D274 PolarHBondContact N-OD2 3.44Å; S271-D274 PolarHBondContact O-N 3.37Å; S271-D274 PolarHBondContact OG-N 3.16Å; S271-D274 VanDerWaalsContact OG-N 3.11Å; S271-D274 PolarHBondContact OG-OD1 3.48Å; S271-D274 PolarHBondContact OG-OD2 2.87Å; S271-L275 PolarHBondContact O-N 3.45Å
272	V	95.8	Very high	94.8	Very high	7 Å²	7	62.4 Å²	62.4	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-59.6	-38	172.3	179	0	0	0	0	110.8	M244 L247 V253 D274 L275 Q276 A299	M244-V272 HydrophobicContact CE-CG1 4.11Å; L247-V272 HydrophobicContact CB-CG2 3.93Å; L247-V272 HydrophobicContact CD1-CG2 4.18Å; V253-V272 HydrophobicContact CG2-CG2 3.72Å; V272-D274 VanDerWaalsContact C-N 3.34Å; V272-D274 PolarHBondContact O-N 3.34Å; V272-L275 WeakPolarHBondContact O-CB 3.3Å; V272-L275 PolarHBondContact O-N 3.43Å; V272-Q276 HydrophobicContact CG1-CG 4.36Å; V272-Q276 VanDerWaalsContact O-CG 3.31Å; V272-Q276 WeakPolarHBondContact O-CG 3.41Å; V272-Q276 PolarHBondContact O-N 2.86Å; V272-A299 HydrophobicContact CG1-CB 4.29Å
273	K	95.6	Very high	95	Very high	139 Å²	139	56.4 Å²	56.4	60%	0.604	33%	0.332	S	S	*	.	H	α-helix	trans	-62.8	-39.3	177.5	-170.6	173.3	-178.3	176.9	0	112.1	S271 L275 Q276 L277	S271-K273 PolarHBondContact O-N 3.29Å; S271-K273 PolarHBondContact OG-N 3.48Å; K273-L275 VanDerWaalsContact C-N 3.33Å; K273-L275 PolarHBondContact O-N 2.89Å; K273-Q276 CarbonylContact O-C 3.29Å; K273-Q276 WeakPolarHBondContact O-CB 3.47Å; K273-Q276 PolarHBondContact O-N 3.02Å; K273-Q276 VanDerWaalsContact O-N 3.16Å; K273-L277 HydrophobicContact CG-CD1 4.05Å; K273-L277 WeakPolarHBondContact O-CG 3.44Å; K273-L277 PolarHBondContact O-N 3.45Å
274	D	95.3	Very high	95.1	Very high	51 Å²	51	53.9 Å²	53.9	27%	0.273	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-44.6	175.4	-53.4	-33.9	0	0	0	110.5	L269 V270 S271 V272 Q276 L277 C278	L269-D274 HydrophobicContact CB-CB 4.22Å; L269-D274 HydrophobicContact CD2-CB 3.76Å; V270-D274 WeakPolarHBondContact CG2-OD2 3.48Å; V270-D274 PolarHBondContact N-OD2 2.92Å; V270-D274 VanDerWaalsContact N-OD2 3.15Å; S271-D274 WeakPolarHBondContact CB-OD2 3.43Å; S271-D274 PolarHBondContact N-OD2 3.44Å; S271-D274 PolarHBondContact O-N 3.37Å; S271-D274 PolarHBondContact OG-N 3.16Å; S271-D274 VanDerWaalsContact OG-N 3.11Å; S271-D274 PolarHBondContact OG-OD1 3.48Å; S271-D274 PolarHBondContact OG-OD2 2.87Å; V272-D274 VanDerWaalsContact C-N 3.34Å; V272-D274 PolarHBondContact O-N 3.34Å; D274-Q276 VanDerWaalsContact C-N 3.27Å; D274-Q276 PolarHBondContact O-N 3.17Å; D274-L277 PolarHBondContact O-N 2.96Å; D274-C278 WeakPolarHBondContact O-CB 3.18Å; D274-C278 PolarHBondContact O-N 3.28Å
275	L	95.4	Very high	95.1	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-64	-33	176.4	-177	58.5	0	0	0	112.4	L250 L264 L269 S271 V272 K273 L277 L283 L295 R296 A299	L250-L275 HydrophobicContact CD2-CB 3.91Å; L250-L275 HydrophobicContact CD2-CD2 3.89Å; L264-L275 HydrophobicContact CD1-CD2 4.42Å; L264-L275 HydrophobicContact CD2-CD1 3.97Å; L269-L275 HydrophobicContact CD1-CD1 4.31Å; S271-L275 PolarHBondContact O-N 3.45Å; V272-L275 WeakPolarHBondContact O-CB 3.3Å; V272-L275 PolarHBondContact O-N 3.43Å; K273-L275 VanDerWaalsContact C-N 3.33Å; K273-L275 PolarHBondContact O-N 2.89Å; L275-L277 VanDerWaalsContact C-N 3.32Å; L275-L283 HydrophobicContact CD1-CD1 3.86Å; L275-L283 HydrophobicContact CD1-CD2 3.8Å; L275-L295 HydrophobicContact CD2-CB 4.48Å; L275-R296 WeakPolarHBondContact O-CD 3.48Å; L275-A299 HydrophobicContact CB-CB 4.2Å; L275-A299 HydrophobicContact CD2-CB 3.75Å; L275-A299 HydrophobicContact CG-CB 3.73Å
276	Q	95.5	Very high	95	Very high	46 Å²	46	61.7 Å²	61.7	22%	0.215	36%	0.356	C	S	.	.	H	α-helix	trans	-74.6	-14.6	172.7	-69.5	174.5	-11.1	0	0	114.2	V272 K273 D274 R296 A299 L300	V272-Q276 HydrophobicContact CG1-CG 4.36Å; V272-Q276 VanDerWaalsContact O-CG 3.31Å; V272-Q276 WeakPolarHBondContact O-CG 3.41Å; V272-Q276 PolarHBondContact O-N 2.86Å; K273-Q276 CarbonylContact O-C 3.29Å; K273-Q276 WeakPolarHBondContact O-CB 3.47Å; K273-Q276 PolarHBondContact O-N 3.02Å; K273-Q276 VanDerWaalsContact O-N 3.16Å; D274-Q276 VanDerWaalsContact C-N 3.27Å; D274-Q276 PolarHBondContact O-N 3.17Å; Q276-R296 VanDerWaalsContact C-CZ 3.46Å; Q276-R296 VanDerWaalsContact CA-NH1 3.34Å; Q276-R296 PolarHBondContact O-NH1 2.8Å; Q276-R296 PolarHBondContact O-NH2 3.42Å; Q276-A299 HydrophobicContact CG-CB 3.89Å; Q276-A299 WeakPolarHBondContact CG-O 3.33Å; Q276-A299 PolarHBondContact NE2-O 2.87Å; Q276-L300 HydrophobicContact CB-CD2 4.38Å; Q276-L300 HydrophobicContact CG-CD2 3.93Å
277	L	95.3	Very high	95.1	Very high	122 Å²	122	58.1 Å²	58.1	64%	0.639	33%	0.326	S	S	*	.	H	α-helix	trans	-107.8	-19.3	178.5	-66.5	175.2	0	0	0	111.8	K273 D274 L275	K273-L277 HydrophobicContact CG-CD1 4.05Å; K273-L277 WeakPolarHBondContact O-CG 3.44Å; K273-L277 PolarHBondContact O-N 3.45Å; D274-L277 PolarHBondContact O-N 2.96Å; L275-L277 VanDerWaalsContact C-N 3.32Å
278	C	94.9	Very high	95.1	Very high	15 Å²	15	56.5 Å²	56.5	10%	0.101	33%	0.325	C	S	.	.	S	Bend	trans	-57.7	130.1	179.7	-168.6	0	0	0	0	111.5	L269 D274 L280 L283 R296	L269-C278 HydrophobicContact CD1-CB 4.12Å; L269-C278 HydrophobicContact CD2-CB 4.03Å; D274-C278 WeakPolarHBondContact O-CB 3.18Å; D274-C278 PolarHBondContact O-N 3.28Å; C278-L280 PolarHBondContact O-N 3.07Å; C278-L283 HydrophobicContact CB-CD1 4.13Å; C278-L283 HydrophobicContact CB-CD2 4.33Å; C278-L283 HydrophobicContact CB-CG 4.13Å; C278-L283 VanDerWaalsContact SG-CG 3.59Å; C278-R296 PolarHBondContact O-NE 3.42Å; C278-R296 PolarHBondContact O-NH2 3.4Å
279	P	95.4	Very high	95.1	Very high	76 Å²	76	56.1 Å²	56.1	49%	0.494	32%	0.321	S	S	.	.			trans	-58.2	133.2	172.7	-24.4	34.7	0	0	0	111.3	G281 D282 L283	P279-G281 PolarHBondContact O-N 2.91Å; P279-D282 PolarHBondContact O-N 3.41Å; P279-D282 VanDerWaalsContact O-N 3.14Å; P279-L283 PolarHBondContact O-N 3.49Å
280	L	95.2	Very high	95.1	Very high	68 Å²	68	61.4 Å²	61.4	36%	0.356	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-31.8	-177.6	-176.5	64.8	0	0	0	112.5	C278 L283 A284 A292 R296	C278-L280 PolarHBondContact O-N 3.07Å; L280-L283 PolarHBondContact O-N 3.35Å; L280-A284 VanDerWaalsContact O-CB 3.24Å; L280-A284 WeakPolarHBondContact O-CB 3.38Å; L280-A284 PolarHBondContact O-N 3.49Å; L280-A292 HydrophobicContact CD1-CB 4.06Å; L280-R296 HydrophobicContact CD1-CB 4.39Å
281	G	96.2	Very high	95.1	Very high	52 Å²	52	59.1 Å²	59.1	54%	0.536	34%	0.34	S	S	.	.	H	α-helix	trans	-62.6	-39.9	177.5	0	0	0	0	0	113.3	P279 A284 R285	P279-G281 PolarHBondContact O-N 2.91Å; G281-A284 PolarHBondContact O-N 2.89Å; G281-R285 PolarHBondContact O-N 2.72Å
282	D	94.4	Very high	95.2	Very high	59 Å²	59	57.3 Å²	57.3	32%	0.316	33%	0.327	S	S	.	.	H	α-helix	trans	-70.6	-43.1	178.6	-64	-39.1	0	0	0	111	P279 A284 R285 E286	P279-D282 PolarHBondContact O-N 3.41Å; P279-D282 VanDerWaalsContact O-N 3.14Å; D282-A284 VanDerWaalsContact C-N 3.29Å; D282-A284 PolarHBondContact O-N 3.44Å; D282-R285 PolarHBondContact O-N 2.63Å; D282-R285 IonicContact OD1-CZ 2.64Å; D282-R285 IonicContact OD1-NH1 2.68Å; D282-R285 IonicContact OD1-NH2 3.69Å; D282-R285 PolarHBondContact OD1-NH2 2.84Å; D282-E286 PolarHBondContact O-N 2.93Å
283	L	95.3	Very high	95.2	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.5	-40.7	172.4	-69.4	174	0	0	0	111.9	L264 L267 L269 L275 C278 P279 L280 E286 L287 A292	L264-L283 HydrophobicContact CD2-CD2 3.83Å; L267-L283 HydrophobicContact CD1-CD2 4.29Å; L269-L283 HydrophobicContact CD1-CD2 3.76Å; L275-L283 HydrophobicContact CD1-CD1 3.86Å; L275-L283 HydrophobicContact CD1-CD2 3.8Å; C278-L283 HydrophobicContact CB-CD1 4.13Å; C278-L283 HydrophobicContact CB-CD2 4.33Å; C278-L283 HydrophobicContact CB-CG 4.13Å; C278-L283 VanDerWaalsContact SG-CG 3.59Å; P279-L283 PolarHBondContact O-N 3.49Å; L280-L283 PolarHBondContact O-N 3.35Å; L283-E286 PolarHBondContact O-N 3.48Å; L283-L287 WeakPolarHBondContact O-CB 3.24Å; L283-L287 PolarHBondContact O-N 3.31Å; L283-A292 HydrophobicContact CB-CB 3.66Å
284	A	96.3	Very high	95.3	Very high	30 Å²	30	59.9 Å²	59.9	25%	0.248	34%	0.336	C	S	.	.	H	α-helix	trans	-69.4	-37.2	-179	0	0	0	0	0	112.4	L280 G281 D282 E286 G288 A292	L280-A284 VanDerWaalsContact O-CB 3.24Å; L280-A284 WeakPolarHBondContact O-CB 3.38Å; L280-A284 PolarHBondContact O-N 3.49Å; G281-A284 PolarHBondContact O-N 2.89Å; D282-A284 VanDerWaalsContact C-N 3.29Å; D282-A284 PolarHBondContact O-N 3.44Å; A284-E286 VanDerWaalsContact C-N 3.31Å; A284-E286 PolarHBondContact O-N 2.89Å; A284-G288 CarbonylContact O-C 3.56Å; A284-G288 WeakPolarHBondContact O-CA 3.34Å; A284-G288 PolarHBondContact O-N 3.29Å; A284-A292 HydrophobicContact CB-CB 4.05Å
285	R	95.3	Very high	95.3	Very high	198 Å²	198	57.5 Å²	57.5	75%	0.747	32%	0.323	S	S	*	.	H	α-helix	trans	-63.3	-38.7	176	-177.6	169.7	58.4	-139.8	-12	111.8	G281 D282	G281-R285 PolarHBondContact O-N 2.72Å; D282-R285 PolarHBondContact O-N 2.63Å; D282-R285 IonicContact OD1-CZ 2.64Å; D282-R285 IonicContact OD1-NH1 2.68Å; D282-R285 IonicContact OD1-NH2 3.69Å; D282-R285 PolarHBondContact OD1-NH2 2.84Å
286	E	93.3	Very high	95.3	Very high	71 Å²	71	60 Å²	60	33%	0.332	33%	0.333	S	S	.	.	H	α-helix	trans	-78.1	-59.7	176.2	-179.2	51.8	-138.5	0	0	110.8	R263 L267 D282 L283 A284	R263-E286 IonicContact CZ-OE1 3.39Å; R263-E286 IonicContact NE-OE1 2.71Å; R263-E286 PolarHBondContact NE-OE1 2.93Å; R263-E286 PolarHBondContact NH2-O 3.35Å; R263-E286 IonicContact NH2-OE1 3.27Å; R263-E286 PolarHBondContact NH2-OE1 3Å; L267-E286 HydrophobicContact CD1-CB 3.77Å; L267-E286 HydrophobicContact CD1-CG 3.83Å; L267-E286 HydrophobicContact CD2-CB 4.13Å; L267-E286 HydrophobicContact CD2-CG 4.19Å; L267-E286 HydrophobicContact CG-CB 4.3Å; L267-E286 HydrophobicContact CG-CG 4.05Å; D282-E286 PolarHBondContact O-N 2.93Å; L283-E286 PolarHBondContact O-N 3.48Å; A284-E286 VanDerWaalsContact C-N 3.31Å; A284-E286 PolarHBondContact O-N 2.89Å
287	L	93.4	Very high	95.4	Very high	12 Å²	12	60 Å²	60	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-97	-7.2	-163.4	-56	174.8	0	0	0	114.8	R263 L264 L283 T291 L295	R263-L287 HydrophobicContact CB-CD2 3.83Å; R263-L287 VanDerWaalsContact CZ-CD2 3.43Å; L264-L287 HydrophobicContact CD2-CD1 3.68Å; L264-L287 HydrophobicContact CG-CD1 4.31Å; L283-L287 WeakPolarHBondContact O-CB 3.24Å; L283-L287 PolarHBondContact O-N 3.31Å; L287-T291 HydrophobicContact CB-CG2 4.08Å; L287-T291 WeakPolarHBondContact O-CB 3.43Å; L287-T291 PolarHBondContact O-OG1 3.45Å; L287-L295 HydrophobicContact CD1-CD1 3.33Å
288	G	95.1	Very high	95.4	Very high	33 Å²	33	54.6 Å²	54.6	34%	0.34	31%	0.306	S	S	.	.			trans	83.5	146.7	-168.7	0	0	0	0	0	112.5	A284 T290 T291 A292	A284-G288 CarbonylContact O-C 3.56Å; A284-G288 WeakPolarHBondContact O-CA 3.34Å; A284-G288 PolarHBondContact O-N 3.29Å; G288-T290 PolarHBondContact O-N 3.5Å; G288-T291 PolarHBondContact O-N 3.3Å; G288-A292 WeakPolarHBondContact O-CB 3.13Å; G288-A292 PolarHBondContact O-N 3.5Å
289	G	95.3	Very high	95.5	Very high	47 Å²	47	53.9 Å²	53.9	49%	0.485	30%	0.301	S	S	.	.	H	α-helix	trans	-55.5	-46.1	-170	0	0	0	0	0	115.2	T291 A292 Q293	G289-T291 PolarHBondContact O-N 2.91Å; G289-A292 PolarHBondContact O-N 3.21Å; G289-Q293 PolarHBondContact O-N 3.04Å
290	T	95.1	Very high	95.6	Very high	128 Å²	128	53.7 Å²	53.7	79%	0.785	30%	0.296	S	S	*	.	H	α-helix	trans	-64.2	-43.7	-179.9	-49.3	0	0	0	0	112.2	G288 R294	G288-T290 PolarHBondContact O-N 3.5Å; T290-R294 WeakPolarHBondContact O-CB 3.25Å; T290-R294 PolarHBondContact O-N 3.4Å
291	T	94.9	Very high	95.6	Very high	49 Å²	49	50.6 Å²	50.6	30%	0.301	28%	0.28	S	S	.	.	H	α-helix	trans	-68.3	-43	179.6	-54.5	0	0	0	0	110.8	L287 G288 G289 R294 L295	L287-T291 HydrophobicContact CB-CG2 4.08Å; L287-T291 WeakPolarHBondContact O-CB 3.43Å; L287-T291 PolarHBondContact O-OG1 3.45Å; G288-T291 PolarHBondContact O-N 3.3Å; G289-T291 PolarHBondContact O-N 2.91Å; T291-R294 PolarHBondContact O-N 3.42Å; T291-L295 HydrophobicContact CG2-CD1 3.88Å; T291-L295 HydrophobicContact CG2-CG 4.33Å; T291-L295 WeakPolarHBondContact O-CB 3.4Å; T291-L295 VanDerWaalsContact O-CG 3.3Å; T291-L295 WeakPolarHBondContact O-CG 3.44Å; T291-L295 PolarHBondContact O-N 3.37Å
292	A	95.9	Very high	95.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-49.8	177.2	0	0	0	0	0	111.7	L280 L283 A284 G288 G289 R294 L295 R296	L280-A292 HydrophobicContact CD1-CB 4.06Å; L283-A292 HydrophobicContact CB-CB 3.66Å; A284-A292 HydrophobicContact CB-CB 4.05Å; G288-A292 WeakPolarHBondContact O-CB 3.13Å; G288-A292 PolarHBondContact O-N 3.5Å; G289-A292 PolarHBondContact O-N 3.21Å; A292-R294 VanDerWaalsContact C-N 3.34Å; A292-R294 PolarHBondContact O-N 3.03Å; A292-L295 PolarHBondContact O-N 3.09Å; A292-R296 WeakPolarHBondContact O-CB 3.45Å; A292-R296 PolarHBondContact O-N 3.25Å
293	Q	96.6	Very high	95.7	Very high	81 Å²	81	49.7 Å²	49.7	38%	0.379	26%	0.262	S	S	.	.	H	α-helix	trans	-61.4	-43.5	177.1	-173.7	63.4	60.2	0	0	111.7	G289 L295 R296 N297	G289-Q293 PolarHBondContact O-N 3.04Å; Q293-L295 PolarHBondContact O-N 3.25Å; Q293-R296 WeakPolarHBondContact O-CB 3.43Å; Q293-R296 PolarHBondContact O-N 3.12Å; Q293-N297 PolarHBondContact NE2-OD1 3.48Å; Q293-N297 VanDerWaalsContact O-CG 3.25Å; Q293-N297 PolarHBondContact O-N 3.47Å; Q293-N297 PolarHBondContact O-OD1 2.89Å
294	R	96.3	Very high	95.7	Very high	120 Å²	120	56.5 Å²	56.5	45%	0.453	29%	0.294	S	S	.	.	H	α-helix	trans	-59.8	-47.5	177.5	-172.6	-179.4	70.7	112.3	5.3	111.4	T290 T291 A292 R296 N297 L298	T290-R294 WeakPolarHBondContact O-CB 3.25Å; T290-R294 PolarHBondContact O-N 3.4Å; T291-R294 PolarHBondContact O-N 3.42Å; A292-R294 VanDerWaalsContact C-N 3.34Å; A292-R294 PolarHBondContact O-N 3.03Å; R294-R296 VanDerWaalsContact C-N 3.34Å; R294-R296 PolarHBondContact O-N 2.8Å; R294-N297 PolarHBondContact O-N 2.88Å; R294-L298 HydrophobicContact CG-CD1 4.29Å; R294-L298 VanDerWaalsContact O-CG 3.3Å; R294-L298 WeakPolarHBondContact O-CG 3.49Å; R294-L298 PolarHBondContact O-N 2.8Å
295	L	95.9	Very high	95.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.9	-38.7	179.3	-72	171	0	0	0	112.4	V256 T260 L275 L287 T291 A292 Q293 N297 L298 A299	V256-L295 HydrophobicContact CG2-CD2 3.66Å; T260-L295 HydrophobicContact CG2-CD1 3.72Å; T260-L295 HydrophobicContact CG2-CD2 4.15Å; L275-L295 HydrophobicContact CD2-CB 4.48Å; L287-L295 HydrophobicContact CD1-CD1 3.33Å; T291-L295 HydrophobicContact CG2-CD1 3.88Å; T291-L295 HydrophobicContact CG2-CG 4.33Å; T291-L295 WeakPolarHBondContact O-CB 3.4Å; T291-L295 VanDerWaalsContact O-CG 3.3Å; T291-L295 WeakPolarHBondContact O-CG 3.44Å; T291-L295 PolarHBondContact O-N 3.37Å; A292-L295 PolarHBondContact O-N 3.09Å; Q293-L295 PolarHBondContact O-N 3.25Å; L295-N297 VanDerWaalsContact C-N 3.32Å; L295-N297 PolarHBondContact O-N 3.14Å; L295-L298 PolarHBondContact O-N 3.34Å; L295-A299 WeakPolarHBondContact O-CB 3.49Å; L295-A299 PolarHBondContact O-N 3.13Å
296	R	95.4	Very high	95.7	Very high	53 Å²	53	50.6 Å²	50.6	20%	0.2	29%	0.285	C	S	.	.	H	α-helix	trans	-59.4	-45	173.8	-167.4	63.1	153	102.4	-12.5	111.6	L275 Q276 C278 L280 A292 Q293 R294 A299 L300	L275-R296 WeakPolarHBondContact O-CD 3.48Å; Q276-R296 VanDerWaalsContact C-CZ 3.46Å; Q276-R296 VanDerWaalsContact CA-NH1 3.34Å; Q276-R296 PolarHBondContact O-NH1 2.8Å; Q276-R296 PolarHBondContact O-NH2 3.42Å; C278-R296 PolarHBondContact O-NE 3.42Å; C278-R296 PolarHBondContact O-NH2 3.4Å; L280-R296 HydrophobicContact CD1-CB 4.39Å; A292-R296 WeakPolarHBondContact O-CB 3.45Å; A292-R296 PolarHBondContact O-N 3.25Å; Q293-R296 WeakPolarHBondContact O-CB 3.43Å; Q293-R296 PolarHBondContact O-N 3.12Å; R294-R296 VanDerWaalsContact C-N 3.34Å; R294-R296 PolarHBondContact O-N 2.8Å; R296-A299 PolarHBondContact O-N 3.04Å; R296-L300 WeakPolarHBondContact O-CG 3.32Å; R296-L300 PolarHBondContact O-N 3.28Å
297	N	97.1	Very high	95.9	Very high	45 Å²	45	47.5 Å²	47.5	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-47.2	177.5	-69.9	4.2	0	0	0	111.1	Q293 R294 L295 A299 L300 G301 I302	Q293-N297 PolarHBondContact NE2-OD1 3.48Å; Q293-N297 VanDerWaalsContact O-CG 3.25Å; Q293-N297 PolarHBondContact O-N 3.47Å; Q293-N297 PolarHBondContact O-OD1 2.89Å; R294-N297 PolarHBondContact O-N 2.88Å; L295-N297 VanDerWaalsContact C-N 3.32Å; L295-N297 PolarHBondContact O-N 3.14Å; N297-A299 VanDerWaalsContact C-N 3.29Å; N297-A299 PolarHBondContact O-N 3.44Å; N297-L300 CarbonylContact O-C 3.6Å; N297-L300 WeakPolarHBondContact O-CA 3.5Å; N297-L300 PolarHBondContact O-N 3.01Å; N297-G301 PolarHBondContact O-N 2.95Å; N297-I302 CarbonylContact C-O 3.59Å; N297-I302 HydrophobicContact CB-CB 4.03Å; N297-I302 HydrophobicContact CB-CG2 4.22Å; N297-I302 WeakPolarHBondContact CB-O 3.42Å; N297-I302 WeakPolarHBondContact O-CB 3.41Å; N297-I302 PolarHBondContact O-N 3.03Å
298	L	97.2	Very high	95.9	Very high	10 Å²	10	50.4 Å²	50.4	5%	0.052	29%	0.289	C	S	.	.	H	α-helix	trans	-59.5	-40.7	178	-67.6	173.2	0	0	0	111.7	L218 M244 V253 R294 L295 L300 G301 I302 D303	L218-L298 HydrophobicContact CB-CD2 4.4Å; L218-L298 HydrophobicContact CD1-CD2 4.43Å; L218-L298 HydrophobicContact CD2-CB 4.28Å; L218-L298 HydrophobicContact CD2-CD2 3.81Å; L218-L298 VanDerWaalsContact CD2-O 3.31Å; L218-L298 WeakPolarHBondContact CD2-O 3.37Å; L218-L298 HydrophobicContact CG-CD2 4.44Å; M244-L298 WeakPolarHBondContact CE-O 3.47Å; V253-L298 HydrophobicContact CG1-CB 3.97Å; R294-L298 HydrophobicContact CG-CD1 4.29Å; R294-L298 VanDerWaalsContact O-CG 3.3Å; R294-L298 WeakPolarHBondContact O-CG 3.49Å; R294-L298 PolarHBondContact O-N 2.8Å; L295-L298 PolarHBondContact O-N 3.34Å; L298-L300 PolarHBondContact O-N 3.43Å; L298-G301 PolarHBondContact O-N 3.48Å; L298-I302 PolarHBondContact N-O 3.49Å; L298-D303 HydrophobicContact CD2-CB 4.25Å
299	A	96.4	Very high	95.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.6	-26.4	176.1	0	0	0	0	0	112.9	V272 L275 Q276 L295 R296 N297	V272-A299 HydrophobicContact CG1-CB 4.29Å; L275-A299 HydrophobicContact CB-CB 4.2Å; L275-A299 HydrophobicContact CD2-CB 3.75Å; L275-A299 HydrophobicContact CG-CB 3.73Å; Q276-A299 HydrophobicContact CG-CB 3.89Å; Q276-A299 WeakPolarHBondContact CG-O 3.33Å; Q276-A299 PolarHBondContact NE2-O 2.87Å; L295-A299 WeakPolarHBondContact O-CB 3.49Å; L295-A299 PolarHBondContact O-N 3.13Å; R296-A299 PolarHBondContact O-N 3.04Å; N297-A299 VanDerWaalsContact C-N 3.29Å; N297-A299 PolarHBondContact O-N 3.44Å
300	L	96.3	Very high	95.4	Very high	72 Å²	72	53.2 Å²	53.2	38%	0.377	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	5.8	176.1	-64.5	169.4	0	0	0	113.1	Q276 R296 N297 L298 I302	Q276-L300 HydrophobicContact CB-CD2 4.38Å; Q276-L300 HydrophobicContact CG-CD2 3.93Å; R296-L300 WeakPolarHBondContact O-CG 3.32Å; R296-L300 PolarHBondContact O-N 3.28Å; N297-L300 CarbonylContact O-C 3.6Å; N297-L300 WeakPolarHBondContact O-CA 3.5Å; N297-L300 PolarHBondContact O-N 3.01Å; L298-L300 PolarHBondContact O-N 3.43Å; L300-I302 VanDerWaalsContact C-N 3.28Å; L300-I302 HydrophobicContact CB-CD1 4.1Å; L300-I302 HydrophobicContact CB-CG1 4.24Å; L300-I302 PolarHBondContact O-N 3.23Å
301	G	96.7	Very high	95	Very high	3 Å²	3	49.8 Å²	49.8	3%	0.031	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	13	-176	0	0	0	0	0	114.3	N216 L219 N297 L298	N216-G301 PolarHBondContact ND2-O 3.26Å; L219-G301 WeakPolarHBondContact CD1-O 3.32Å; N297-G301 PolarHBondContact O-N 2.95Å; L298-G301 PolarHBondContact O-N 3.48Å
302	I	96.3	Very high	94.7	Very high	68 Å²	68	50.2 Å²	50.2	35%	0.349	29%	0.29	S	S	.	.			trans	-97.1	120.2	-177.9	-58.8	170.7	0	0	0	109.6	N297 L298 L300	N297-I302 CarbonylContact C-O 3.59Å; N297-I302 HydrophobicContact CB-CB 4.03Å; N297-I302 HydrophobicContact CB-CG2 4.22Å; N297-I302 WeakPolarHBondContact CB-O 3.42Å; N297-I302 WeakPolarHBondContact O-CB 3.41Å; N297-I302 PolarHBondContact O-N 3.03Å; L298-I302 PolarHBondContact N-O 3.49Å; L300-I302 VanDerWaalsContact C-N 3.28Å; L300-I302 HydrophobicContact CB-CD1 4.1Å; L300-I302 HydrophobicContact CB-CG1 4.24Å; L300-I302 PolarHBondContact O-N 3.23Å
303	D	96.4	Very high	94.5	Very high	24 Å²	24	51.7 Å²	51.7	13%	0.128	30%	0.3	C	S	.	.			trans	-138.4	104.1	175.3	-179.2	9.5	0	0	0	111.6	R44 N216 L218 L298 S305	R44-D303 PolarHBondContact NH2-O 3.03Å; N216-D303 HydrophobicContact CB-CB 4.13Å; N216-D303 VanDerWaalsContact CB-O 3.29Å; N216-D303 WeakPolarHBondContact CB-O 3.47Å; L218-D303 HydrophobicContact CB-CB 3.72Å; L218-D303 PolarHBondContact N-OD2 3.07Å; L298-D303 HydrophobicContact CD2-CB 4.25Å; D303-S305 VanDerWaalsContact C-N 3.27Å; D303-S305 VanDerWaalsContact CG-OG 3.25Å; D303-S305 PolarHBondContact O-N 3.1Å; D303-S305 WeakPolarHBondContact OD1-CB 3.41Å; D303-S305 PolarHBondContact OD1-N 3.11Å; D303-S305 PolarHBondContact OD1-OG 3.34Å; D303-S305 PolarHBondContact OD2-OG 2.93Å
304	E	94.4	Very high	94.3	Very high	142 Å²	142	56 Å²	56	66%	0.664	32%	0.32	S	S	*	.			trans	-82.5	-0.4	179	-62.1	-54.6	142.6	0	0	113.5	A306	E304-A306 PolarHBondContact O-N 2.83Å
305	S	95.4	Very high	94.3	Very high	48 Å²	48	52.8 Å²	52.8	34%	0.336	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-66	133.9	179.1	70.2	0	0	0	0	111	R44 K217 D303	R44-S305 PolarHBondContact NH1-O 3.49Å; K217-S305 WeakPolarHBondContact CE-OG 3.24Å; D303-S305 VanDerWaalsContact C-N 3.27Å; D303-S305 VanDerWaalsContact CG-OG 3.25Å; D303-S305 PolarHBondContact O-N 3.1Å; D303-S305 WeakPolarHBondContact OD1-CB 3.41Å; D303-S305 PolarHBondContact OD1-N 3.11Å; D303-S305 PolarHBondContact OD1-OG 3.34Å; D303-S305 PolarHBondContact OD2-OG 2.93Å
306	A	96.6	Very high	94.3	Very high	57 Å²	57	53.7 Å²	53.7	47%	0.471	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-77.3	156.3	176.8	0	0	0	0	0	110.9	K217 E304 T308	K217-A306 WeakPolarHBondContact CE-O 3.48Å; K217-A306 PolarHBondContact NZ-O 3.4Å; E304-A306 PolarHBondContact O-N 2.83Å; A306-T308 PolarHBondContact O-N 2.88Å
307	V	97.7	Very high	94.4	Very high	6 Å²	6	53.5 Å²	53.5	4%	0.036	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-74.7	117.4	162.5	-178.7	0	0	0	0	107.3	I46 L135 E137 F145 D147 K217	I46-V307 HydrophobicContact CD1-CG2 3.96Å; I46-V307 HydrophobicContact CG2-CG2 4.14Å; L135-V307 WeakPolarHBondContact O-CG1 3.43Å; E137-V307 HydrophobicContact CB-CG1 3.66Å; E137-V307 WeakPolarHBondContact OE2-CA 3.38Å; F145-V307 HydrophobicContact CB-CG1 4.14Å; F145-V307 HydrophobicContact CB-CG2 4.05Å; D147-V307 HydrophobicContact CB-CB 3.92Å; D147-V307 HydrophobicContact CB-CG2 3.91Å; K217-V307 HydrophobicContact CD-CG2 3.93Å; K217-V307 HydrophobicContact CG-CG2 3.97Å
308	T	93.7	Very high	94.4	Very high	73 Å²	73	53.1 Å²	53.1	45%	0.448	33%	0.325	S	S	.	.			trans	-110	126.4	-177.2	53.8	0	0	0	0	110.3	E137 A306 T310	E137-T308 WeakPolarHBondContact CA-O 3.47Å; E137-T308 WeakPolarHBondContact CB-O 3.45Å; E137-T308 WeakPolarHBondContact CG-O 3.37Å; E137-T308 PolarHBondContact OE2-N 3.08Å; E137-T308 PolarHBondContact OE2-OG1 3.21Å; A306-T308 PolarHBondContact O-N 2.88Å; T308-T310 PolarHBondContact O-N 2.94Å
309	P	92	Very high	94.3	Very high	78 Å²	78	57.4 Å²	57.4	51%	0.506	35%	0.345	S	S	.	.			trans	-55	117.6	175.6	-26.6	34.9	0	0	0	111	L135 V136 G311	L135-P309 HydrophobicContact CD2-CG 4.05Å; V136-P309 WeakPolarHBondContact O-CA 3.36Å; P309-G311 PolarHBondContact O-N 2.76Å
310	T	87.4	Confident	94.3	Very high	61 Å²	61	58.4 Å²	58.4	37%	0.374	35%	0.351	S	S	.	.			trans	-65.4	-30.6	-176.3	-55.9	0	0	0	0	112.2	V136 E137 R138 T308	V136-T310 PolarHBondContact O-N 2.96Å; E137-T310 WeakPolarHBondContact CA-OG1 3.43Å; R138-T310 HydrophobicContact CB-CG2 4.22Å; R138-T310 PolarHBondContact N-OG1 2.71Å; T308-T310 PolarHBondContact O-N 2.94Å
311	G	85.9	Confident	94.2	Very high	56 Å²	56	56.8 Å²	56.8	58%	0.577	35%	0.346	S	S	*	.			trans	62.6	-161	-176.7	0	0	0	0	0	112.9	P309	P309-G311 PolarHBondContact O-N 2.76Å
312	A	88.8	Confident	94.1	Very high	57 Å²	57	58.5 Å²	58.5	47%	0.471	35%	0.352	S	S	.	.	S	Bend	trans	-67	147.5	175.4	0	0	0	0	0	111.1	Q314	A312-Q314 PolarHBondContact O-N 3.21Å
313	P	91.8	Very high	93.8	Very high	32 Å²	32	63.7 Å²	63.7	21%	0.208	37%	0.367	C	S	.	.			trans	-57.5	139.9	-177.5	19.3	-29.1	0	0	0	111.7	Y123 S315 L316 R351 L429	Y123-P313 WeakPolarHBondContact OH-CD 3.31Å; Y123-P313 VanDerWaalsContact OH-CG 3.24Å; Y123-P313 WeakPolarHBondContact OH-CG 3.38Å; P313-S315 VanDerWaalsContact C-N 3.34Å; P313-L316 HydrophobicContact CB-CD1 4.35Å; P313-L316 HydrophobicContact CG-CD1 4.04Å; P313-R351 VanDerWaalsContact O-CZ 3.3Å; P313-R351 PolarHBondContact O-NH1 3.19Å; P313-R351 PolarHBondContact O-NH2 3.14Å; P313-L429 WeakPolarHBondContact O-CD1 3.37Å
314	Q	92.5	Very high	93.7	Very high	170 Å²	170	69.4 Å²	69.4	79%	0.794	39%	0.391	S	S	*	.	S	Bend	trans	-78.2	-22	-178.6	-64.9	-175.6	-11.4	0	0	113.2	A312	A312-Q314 PolarHBondContact O-N 3.21Å
315	S	96.3	Very high	93.7	Very high	54 Å²	54	63.5 Å²	63.5	38%	0.378	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151	176.7	59	0	0	0	0	110.5	P313 F426	P313-S315 VanDerWaalsContact C-N 3.34Å; S315-F426 CarbonylContact C-O 3.52Å; S315-F426 WeakPolarHBondContact CA-O 3.49Å; S315-F426 VanDerWaalsContact CB-O 3.23Å; S315-F426 WeakPolarHBondContact CB-O 3.32Å
316	L	96.3	Very high	93.7	Very high	19 Å²	19	63.6 Å²	63.6	10%	0.099	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.1	169.9	-78.9	68.5	0	0	0	107.8	P313 L342 R345 M346 D349 C425 F426 L429	P313-L316 HydrophobicContact CB-CD1 4.35Å; P313-L316 HydrophobicContact CG-CD1 4.04Å; L316-L342 HydrophobicContact CB-CD1 3.65Å; L316-R345 HydrophobicContact CD2-CB 4.16Å; L316-M346 HydrophobicContact CD2-SD 4.12Å; L316-D349 HydrophobicContact CD2-CB 4.38Å; L316-C425 CarbonylContact O-C 3.46Å; L316-C425 WeakPolarHBondContact O-CA 3.14Å; L316-C425 PolarHBondContact O-SG 2.84Å; L316-F426 PolarHBondContact N-O 3.43Å; L316-F426 PolarHBondContact O-N 2.95Å; L316-L429 HydrophobicContact CD1-CD1 3.45Å; L316-L429 VanDerWaalsContact CD1-CD1 3.45Å
317	S	97.3	Very high	93.7	Very high	49 Å²	49	62.9 Å²	62.9	34%	0.343	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	156.9	177	62.7	0	0	0	0	111.8	R345 V424	S317-R345 PolarHBondContact O-NH2 2.9Å; S317-V424 CarbonylContact C-O 3.55Å; S317-V424 WeakPolarHBondContact CA-O 3.24Å; S317-V424 WeakPolarHBondContact CB-O 3.41Å
318	D	96.9	Very high	93.7	Very high	36 Å²	36	64.8 Å²	64.8	19%	0.193	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.6	162.4	-74.4	-34.8	0	0	0	109.3	L338 L342 R345 N423 V424	D318-L338 HydrophobicContact CB-CB 4.36Å; D318-L338 HydrophobicContact CB-CD2 3.84Å; D318-L342 PolarHBondContact OD2-N 2.92Å; D318-R345 VanDerWaalsContact CG-CZ 3.44Å; D318-R345 IonicContact OD1-CZ 2.72Å; D318-R345 IonicContact OD1-NH1 2.75Å; D318-R345 PolarHBondContact OD1-NH1 3.27Å; D318-R345 IonicContact OD1-NH2 2.86Å; D318-R345 PolarHBondContact OD1-NH2 3.38Å; D318-R345 IonicContact OD2-CZ 2.96Å; D318-R345 IonicContact OD2-NE 2.88Å; D318-R345 IonicContact OD2-NH1 3.75Å; D318-R345 IonicContact OD2-NH2 3.6Å; D318-R345 PolarHBondContact OD2-NH2 2.97Å; D318-N423 WeakPolarHBondContact O-CA 3.15Å; D318-N423 PolarHBondContact O-ND2 3.17Å; D318-V424 PolarHBondContact N-O 2.8Å; D318-V424 PolarHBondContact O-N 3.21Å
319	E	96.3	Very high	93.8	Very high	100 Å²	100	70 Å²	70	47%	0.467	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.8	175.9	66.9	179.2	-174.8	0	0	111	R372 I422 N423	E319-R372 IonicContact OE2-CZ 2.83Å; E319-R372 IonicContact OE2-NH1 2.7Å; E319-R372 PolarHBondContact OE2-NH1 2.79Å; E319-R372 IonicContact OE2-NH2 3.99Å; E319-I422 VanDerWaalsContact CA-O 3.31Å; E319-I422 WeakPolarHBondContact CA-O 3.36Å; E319-N423 HydrophobicContact CB-CB 3.74Å
320	D	96.3	Very high	94	Very high	22 Å²	22	71 Å²	71	12%	0.118	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	136.3	168.7	-167.2	9.2	0	0	0	109.7	K76 K334 L338 L421 I422	K76-D320 WeakPolarHBondContact CE-OD1 3.49Å; K76-D320 IonicContact NZ-OD1 2.71Å; K76-D320 PolarHBondContact NZ-OD1 3.05Å; K76-D320 IonicContact NZ-OD2 3.51Å; D320-K334 HydrophobicContact CB-CD 4.02Å; D320-K334 WeakPolarHBondContact OD2-CD 3.36Å; D320-K334 VanDerWaalsContact OD2-CE 3.25Å; D320-K334 WeakPolarHBondContact OD2-CE 3.44Å; D320-K334 IonicContact OD2-NZ 2.76Å; D320-K334 PolarHBondContact OD2-NZ 3.06Å; D320-L338 HydrophobicContact CB-CD2 4.13Å; D320-L421 VanDerWaalsContact O-CA 3.31Å; D320-L421 WeakPolarHBondContact O-CA 3.25Å; D320-I422 PolarHBondContact N-O 2.83Å; D320-I422 PolarHBondContact O-N 2.7Å
321	S	94.1	Very high	94.5	Very high	38 Å²	38	68 Å²	68	27%	0.266	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	138.2	174.9	-68.9	0	0	0	0	109.9	K76 T420	K76-S321 WeakPolarHBondContact CE-O 3.4Å; S321-T420 WeakPolarHBondContact CA-O 3.36Å
322	F	93.2	Very high	95.1	Very high	39 Å²	39	67 Å²	67	17%	0.171	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	160.6	-175.5	41.8	-99	0	0	0	110.8	M325 K334 L419 T420 I422	F322-M325 HydrophobicContact CD1-CE 3.89Å; F322-M325 HydrophobicContact CD2-CB 3.68Å; F322-M325 HydrophobicContact CD2-CE 4.19Å; F322-M325 HydrophobicContact CE1-CE 3.67Å; F322-M325 HydrophobicContact CE1-SD 4.23Å; F322-M325 HydrophobicContact CE2-CB 3.22Å; F322-M325 HydrophobicContact CE2-CE 3.97Å; F322-M325 HydrophobicContact CE2-CG 4.24Å; F322-M325 HydrophobicContact CE2-SD 4.07Å; F322-M325 HydrophobicContact CG-CE 4.14Å; F322-M325 HydrophobicContact CZ-CB 3.89Å; F322-M325 HydrophobicContact CZ-CE 3.69Å; F322-M325 HydrophobicContact CZ-CG 4.49Å; F322-M325 HydrophobicContact CZ-SD 3.74Å; F322-K334 HydrophobicContact CE1-CG 4.46Å; F322-L419 WeakPolarHBondContact CD2-O 3.06Å; F322-L419 VanDerWaalsContact CE2-C 3.43Å; F322-L419 HydrophobicContact CE2-CB 3.9Å; F322-L419 WeakPolarHBondContact CE2-O 3.3Å; F322-L419 HydrophobicContact CZ-CB 4.21Å; F322-T420 PolarHBondContact N-O 3.36Å; F322-T420 VanDerWaalsContact O-CA 3.3Å; F322-T420 WeakPolarHBondContact O-CA 3.46Å; F322-I422 HydrophobicContact CE1-CB 4.29Å; F322-I422 HydrophobicContact CE1-CD1 4.04Å; F322-I422 HydrophobicContact CE1-CG1 4.08Å; F322-I422 HydrophobicContact CZ-CD1 3.83Å; F322-I422 HydrophobicContact CZ-CG1 3.85Å
323	R	90.9	Very high	95.5	Very high	176 Å²	176	67 Å²	67	66%	0.664	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	-47.1	-177.8	-68.7	-172.3	179.9	-153.7	-2.5	112.2	Y77 H418	Y77-R323 HydrophobicContact CE2-CG 4.2Å; Y77-R323 VanDerWaalsContact CZ-NE 3.31Å; Y77-R323 PolarHBondContact OH-NE 3.39Å; R323-H418 PolarHBondContact O-NE2 3.19Å
324	K	93.4	Very high	95.8	Very high	145 Å²	145	67 Å²	67	63%	0.63	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-155.1	132.7	-175.6	-177.1	172.7	-179.2	179.4	0	110.5	C326 H418	K324-C326 WeakPolarHBondContact CE-SG 3.39Å; K324-C326 WeakPolarHBondContact CG-SG 3.49Å; K324-H418 WeakPolarHBondContact CA-NE2 3.48Å
325	M	95.4	Very high	96.1	Very high	17 Å²	17	59 Å²	59	8%	0.084	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	125.6	167.6	-169.7	176.1	-70.7	0	0	108.4	F322 E330 V331 K334 L419 I422	F322-M325 HydrophobicContact CD1-CE 3.89Å; F322-M325 HydrophobicContact CD2-CB 3.68Å; F322-M325 HydrophobicContact CD2-CE 4.19Å; F322-M325 HydrophobicContact CE1-CE 3.67Å; F322-M325 HydrophobicContact CE1-SD 4.23Å; F322-M325 HydrophobicContact CE2-CB 3.22Å; F322-M325 HydrophobicContact CE2-CE 3.97Å; F322-M325 HydrophobicContact CE2-CG 4.24Å; F322-M325 HydrophobicContact CE2-SD 4.07Å; F322-M325 HydrophobicContact CG-CE 4.14Å; F322-M325 HydrophobicContact CZ-CB 3.89Å; F322-M325 HydrophobicContact CZ-CE 3.69Å; F322-M325 HydrophobicContact CZ-CG 4.49Å; F322-M325 HydrophobicContact CZ-SD 3.74Å; M325-E330 HydrophobicContact CE-CB 4.48Å; M325-E330 HydrophobicContact CG-CB 3.7Å; M325-E330 HydrophobicContact SD-CB 4.08Å; M325-V331 HydrophobicContact CG-CG2 3.94Å; M325-V331 VanDerWaalsContact SD-CA 3.59Å; M325-V331 HydrophobicContact SD-CB 4.23Å; M325-V331 HydrophobicContact SD-CG2 3.64Å; M325-K334 HydrophobicContact CE-CB 3.95Å; M325-K334 HydrophobicContact CE-CG 4.16Å; M325-K334 HydrophobicContact SD-CB 4.39Å; M325-L419 HydrophobicContact CB-CB 4.48Å; M325-L419 PolarHBondContact N-O 3.08Å; M325-L419 PolarHBondContact O-N 3.01Å; M325-I422 HydrophobicContact SD-CD1 3.69Å
326	C	94.9	Very high	96.2	Very high	50 Å²	50	61.5 Å²	61.5	34%	0.338	31%	0.309	S	S	.	.			trans	-132.8	-4.4	-166.6	-66.1	0	0	0	0	113.7	K324 F417	K324-C326 WeakPolarHBondContact CE-SG 3.39Å; K324-C326 WeakPolarHBondContact CG-SG 3.49Å; C326-F417 WeakPolarHBondContact CA-O 3.4Å; C326-F417 WeakPolarHBondContact CB-O 3.26Å; C326-F417 WeakPolarHBondContact O-CZ 3.19Å; C326-F417 PolarHBondContact SG-O 2.55Å
327	S	96.6	Very high	96.2	Very high	43 Å²	43	66.2 Å²	66.2	30%	0.301	33%	0.331	S	S	.	.			trans	-116	142.4	179	74.5	0	0	0	0	111.8	K329 E330 V331	S327-K329 PolarHBondContact O-N 3.2Å; S327-E330 PolarHBondContact N-OE2 3.49Å; S327-E330 PolarHBondContact O-N 3.42Å; S327-E330 VanDerWaalsContact OG-CB 3.31Å; S327-E330 WeakPolarHBondContact OG-CB 3.47Å; S327-E330 WeakPolarHBondContact OG-CG 3.31Å; S327-E330 PolarHBondContact OG-N 2.91Å; S327-E330 PolarHBondContact OG-OE2 3.45Å; S327-V331 WeakPolarHBondContact O-CG2 3.23Å; S327-V331 PolarHBondContact O-N 3.2Å; S327-V331 VanDerWaalsContact O-N 3.09Å
328	V	96.8	Very high	96.1	Very high	45 Å²	45	64.7 Å²	64.7	27%	0.273	32%	0.318	S	S	.	.	H	α-helix	trans	-60.2	-35.1	176.3	-176.4	0	0	0	0	110.6	V331 M332 F407 C413 F417	V328-V331 PolarHBondContact O-N 3.21Å; V328-M332 HydrophobicContact CG1-CE 4Å; V328-M332 HydrophobicContact CG1-CG 4.24Å; V328-M332 WeakPolarHBondContact O-CG 3.37Å; V328-M332 PolarHBondContact O-N 3.44Å; V328-F407 HydrophobicContact CG1-CE1 4.41Å; V328-F407 HydrophobicContact CG2-CE1 4.26Å; V328-C413 HydrophobicContact CG2-CB 3.95Å; V328-F417 HydrophobicContact CG2-CE1 4.12Å; V328-F417 HydrophobicContact CG2-CZ 4.19Å
329	K	96.9	Very high	96.2	Very high	183 Å²	183	63 Å²	63	80%	0.796	31%	0.309	S	S	*	.	H	α-helix	trans	-60.5	-48.2	177.3	-174.6	-179	176.7	-176.6	0	111.9	S327 M332 A333	S327-K329 PolarHBondContact O-N 3.2Å; K329-M332 PolarHBondContact O-N 2.95Å; K329-A333 WeakPolarHBondContact O-CB 3.44Å; K329-A333 PolarHBondContact O-N 3.44Å
330	E	97.1	Very high	96	Very high	98 Å²	98	59.4 Å²	59.4	46%	0.458	30%	0.3	S	S	.	.	H	α-helix	trans	-63.4	-41.7	176.4	-72.3	162.8	159.1	0	0	111.7	M325 S327 A333 K334	M325-E330 HydrophobicContact CE-CB 4.48Å; M325-E330 HydrophobicContact CG-CB 3.7Å; M325-E330 HydrophobicContact SD-CB 4.08Å; S327-E330 PolarHBondContact N-OE2 3.49Å; S327-E330 PolarHBondContact O-N 3.42Å; S327-E330 VanDerWaalsContact OG-CB 3.31Å; S327-E330 WeakPolarHBondContact OG-CB 3.47Å; S327-E330 WeakPolarHBondContact OG-CG 3.31Å; S327-E330 PolarHBondContact OG-N 2.91Å; S327-E330 PolarHBondContact OG-OE2 3.45Å; E330-A333 PolarHBondContact O-N 2.98Å; E330-K334 WeakPolarHBondContact O-CB 3.27Å; E330-K334 PolarHBondContact O-N 2.92Å
331	V	97.5	Very high	95.8	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.2	-49.7	177.6	170.9	0	0	0	0	111	M325 S327 V328 A333 K334 I335 F407 F417 L419 I422	M325-V331 HydrophobicContact CG-CG2 3.94Å; M325-V331 VanDerWaalsContact SD-CA 3.59Å; M325-V331 HydrophobicContact SD-CB 4.23Å; M325-V331 HydrophobicContact SD-CG2 3.64Å; S327-V331 WeakPolarHBondContact O-CG2 3.23Å; S327-V331 PolarHBondContact O-N 3.2Å; S327-V331 VanDerWaalsContact O-N 3.09Å; V328-V331 PolarHBondContact O-N 3.21Å; V331-A333 PolarHBondContact O-N 3.11Å; V331-K334 PolarHBondContact O-N 2.61Å; V331-I335 HydrophobicContact CG1-CD1 3.75Å; V331-I335 HydrophobicContact CG1-CG1 4.48Å; V331-I335 VanDerWaalsContact O-CG1 3.29Å; V331-I335 WeakPolarHBondContact O-CG1 3.32Å; V331-I335 PolarHBondContact O-N 3.26Å; V331-F407 HydrophobicContact CB-CZ 4.4Å; V331-F407 HydrophobicContact CG1-CD2 3.87Å; V331-F407 HydrophobicContact CG1-CE1 4.38Å; V331-F407 HydrophobicContact CG1-CE2 3.73Å; V331-F407 HydrophobicContact CG1-CG 4.26Å; V331-F407 HydrophobicContact CG1-CZ 4Å; V331-F407 HydrophobicContact CG2-CE2 4.28Å; V331-F407 HydrophobicContact CG2-CZ 4.07Å; V331-F417 HydrophobicContact CG2-CE2 4.1Å; V331-F417 HydrophobicContact CG2-CZ 4.41Å; V331-L419 HydrophobicContact CG2-CD1 3.86Å; V331-I422 HydrophobicContact CB-CD1 4.35Å; V331-I422 HydrophobicContact CG1-CD1 3.96Å; V331-I422 HydrophobicContact CG2-CD1 4.33Å
332	M	97.9	Very high	95.9	Very high	34 Å²	34	58.1 Å²	58.1	17%	0.167	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-38.3	-179.4	-64.2	-56	146.8	0	0	112	V328 K329 I335 Q336 F407	V328-M332 HydrophobicContact CG1-CE 4Å; V328-M332 HydrophobicContact CG1-CG 4.24Å; V328-M332 WeakPolarHBondContact O-CG 3.37Å; V328-M332 PolarHBondContact O-N 3.44Å; K329-M332 PolarHBondContact O-N 2.95Å; M332-I335 PolarHBondContact O-N 3.46Å; M332-I335 HydrophobicContact SD-CD1 4.21Å; M332-Q336 WeakPolarHBondContact O-CB 3.39Å; M332-Q336 PolarHBondContact O-N 2.94Å; M332-F407 HydrophobicContact CE-CB 3.87Å; M332-F407 HydrophobicContact CE-CD1 3.63Å; M332-F407 HydrophobicContact CE-CE1 4.44Å; M332-F407 HydrophobicContact CE-CG 3.87Å
333	A	97.8	Very high	96	Very high	58 Å²	58	56.3 Å²	56.3	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-43.6	174.7	0	0	0	0	0	111.8	K329 E330 V331 Q336 E337	K329-A333 WeakPolarHBondContact O-CB 3.44Å; K329-A333 PolarHBondContact O-N 3.44Å; E330-A333 PolarHBondContact O-N 2.98Å; V331-A333 PolarHBondContact O-N 3.11Å; A333-Q336 WeakPolarHBondContact O-CB 3.4Å; A333-Q336 PolarHBondContact O-N 3.01Å; A333-E337 PolarHBondContact O-N 3.3Å
334	K	97.8	Very high	96.2	Very high	32 Å²	32	51.9 Å²	51.9	14%	0.139	28%	0.276	C	S	.	.	H	α-helix	trans	-66.7	-39.5	176.9	-177.7	55	59.2	172.6	0	112.3	D320 F322 M325 E330 V331 Q336 E337 L338 I422	D320-K334 HydrophobicContact CB-CD 4.02Å; D320-K334 WeakPolarHBondContact OD2-CD 3.36Å; D320-K334 VanDerWaalsContact OD2-CE 3.25Å; D320-K334 WeakPolarHBondContact OD2-CE 3.44Å; D320-K334 IonicContact OD2-NZ 2.76Å; D320-K334 PolarHBondContact OD2-NZ 3.06Å; F322-K334 HydrophobicContact CE1-CG 4.46Å; M325-K334 HydrophobicContact CE-CB 3.95Å; M325-K334 HydrophobicContact CE-CG 4.16Å; M325-K334 HydrophobicContact SD-CB 4.39Å; E330-K334 WeakPolarHBondContact O-CB 3.27Å; E330-K334 PolarHBondContact O-N 2.92Å; V331-K334 PolarHBondContact O-N 2.61Å; K334-Q336 VanDerWaalsContact C-N 3.32Å; K334-Q336 PolarHBondContact O-N 2.77Å; K334-E337 WeakPolarHBondContact CE-OE2 3.48Å; K334-E337 IonicContact NZ-OE1 2.7Å; K334-E337 PolarHBondContact NZ-OE1 3.46Å; K334-E337 IonicContact NZ-OE2 3.84Å; K334-E337 PolarHBondContact NZ-OE2 2.94Å; K334-E337 PolarHBondContact O-N 3.19Å; K334-L338 HydrophobicContact CD-CD1 4.48Å; K334-L338 HydrophobicContact CD-CG 4.35Å; K334-L338 HydrophobicContact CG-CD1 4.34Å; K334-L338 WeakPolarHBondContact O-CG 3.31Å; K334-L338 PolarHBondContact O-N 3.22Å; K334-I422 HydrophobicContact CB-CD1 4.2Å; K334-I422 HydrophobicContact CG-CD1 4.11Å
335	I	98.1	Very high	96.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-43.6	173.5	-72.3	168.2	0	0	0	110.6	V331 M332 L338 L339 L358 V400 A403 I422 V424	V331-I335 HydrophobicContact CG1-CD1 3.75Å; V331-I335 HydrophobicContact CG1-CG1 4.48Å; V331-I335 VanDerWaalsContact O-CG1 3.29Å; V331-I335 WeakPolarHBondContact O-CG1 3.32Å; V331-I335 PolarHBondContact O-N 3.26Å; M332-I335 PolarHBondContact O-N 3.46Å; M332-I335 HydrophobicContact SD-CD1 4.21Å; I335-L338 PolarHBondContact O-N 3.36Å; I335-L339 HydrophobicContact CG2-CD1 3.73Å; I335-L339 HydrophobicContact CG2-CG 4.27Å; I335-L339 WeakPolarHBondContact O-CB 3.14Å; I335-L339 VanDerWaalsContact O-CG 3.24Å; I335-L339 WeakPolarHBondContact O-CG 3.37Å; I335-L339 PolarHBondContact O-N 2.63Å; I335-L358 HydrophobicContact CD1-CD1 3.89Å; I335-L358 HydrophobicContact CD1-CD2 4.15Å; I335-L358 HydrophobicContact CG1-CD1 4.11Å; I335-V400 HydrophobicContact CG2-CG2 4.48Å; I335-A403 HydrophobicContact CD1-CB 4.17Å; I335-A403 HydrophobicContact CG2-CB 3.62Å; I335-I422 HydrophobicContact CG1-CG2 3.84Å; I335-V424 HydrophobicContact CG2-CG1 4.25Å
336	Q	97.9	Very high	96.1	Very high	108 Å²	108	46.1 Å²	46.1	51%	0.505	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-44.3	177.7	-176.9	174.6	-51.6	0	0	111.9	M332 A333 K334 L339 G340 V396 V400	M332-Q336 WeakPolarHBondContact O-CB 3.39Å; M332-Q336 PolarHBondContact O-N 2.94Å; A333-Q336 WeakPolarHBondContact O-CB 3.4Å; A333-Q336 PolarHBondContact O-N 3.01Å; K334-Q336 VanDerWaalsContact C-N 3.32Å; K334-Q336 PolarHBondContact O-N 2.77Å; Q336-L339 PolarHBondContact O-N 3.03Å; Q336-G340 PolarHBondContact O-N 3.48Å; Q336-G340 VanDerWaalsContact O-N 3.07Å; Q336-V396 HydrophobicContact CG-CG1 3.78Å; Q336-V400 HydrophobicContact CB-CG2 3.8Å; Q336-V400 HydrophobicContact CG-CG2 4.17Å
337	E	96.3	Very high	96.1	Very high	118 Å²	118	47.1 Å²	47.1	55%	0.551	25%	0.249	S	C	*	.	H	α-helix	trans	-57.7	-51.6	175.2	-178.3	-168.9	146	0	0	111.7	A333 K334 L339 G340	A333-E337 PolarHBondContact O-N 3.3Å; K334-E337 WeakPolarHBondContact CE-OE2 3.48Å; K334-E337 IonicContact NZ-OE1 2.7Å; K334-E337 PolarHBondContact NZ-OE1 3.46Å; K334-E337 IonicContact NZ-OE2 3.84Å; K334-E337 PolarHBondContact NZ-OE2 2.94Å; K334-E337 PolarHBondContact O-N 3.19Å; E337-L339 VanDerWaalsContact C-N 3.3Å; E337-L339 PolarHBondContact O-N 2.85Å; E337-G340 PolarHBondContact O-N 3.13Å
338	L	97.1	Very high	95.8	Very high	16 Å²	16	52.1 Å²	52.1	8%	0.084	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-36.9	179.1	-66.2	171	0	0	0	112.4	D318 D320 K334 I335 G340 L342 I422 V424	D318-L338 HydrophobicContact CB-CB 4.36Å; D318-L338 HydrophobicContact CB-CD2 3.84Å; D320-L338 HydrophobicContact CB-CD2 4.13Å; K334-L338 HydrophobicContact CD-CD1 4.48Å; K334-L338 HydrophobicContact CD-CG 4.35Å; K334-L338 HydrophobicContact CG-CD1 4.34Å; K334-L338 WeakPolarHBondContact O-CG 3.31Å; K334-L338 PolarHBondContact O-N 3.22Å; I335-L338 PolarHBondContact O-N 3.36Å; L338-G340 VanDerWaalsContact C-N 3.31Å; L338-G340 PolarHBondContact O-N 3.47Å; L338-L342 WeakPolarHBondContact O-CB 3.46Å; L338-L342 PolarHBondContact O-N 3.47Å; L338-L342 VanDerWaalsContact O-N 3.16Å; L338-I422 HydrophobicContact CD1-CB 4.35Å; L338-I422 HydrophobicContact CD1-CG2 3.83Å; L338-V424 HydrophobicContact CB-CG2 3.53Å; L338-V424 HydrophobicContact CD1-CG2 4.37Å
339	L	97	Very high	95.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.9	-31.6	177.3	-78.7	173.2	0	0	0	112.6	I335 Q336 E337 L342 V343 F356 V396 L399 V400 V424 F426	I335-L339 HydrophobicContact CG2-CD1 3.73Å; I335-L339 HydrophobicContact CG2-CG 4.27Å; I335-L339 WeakPolarHBondContact O-CB 3.14Å; I335-L339 VanDerWaalsContact O-CG 3.24Å; I335-L339 WeakPolarHBondContact O-CG 3.37Å; I335-L339 PolarHBondContact O-N 2.63Å; Q336-L339 PolarHBondContact O-N 3.03Å; E337-L339 VanDerWaalsContact C-N 3.3Å; E337-L339 PolarHBondContact O-N 2.85Å; L339-L342 PolarHBondContact O-N 2.93Å; L339-V343 VanDerWaalsContact O-CB 3.3Å; L339-V343 WeakPolarHBondContact O-CB 3.44Å; L339-V343 WeakPolarHBondContact O-CG2 3.3Å; L339-V343 PolarHBondContact O-N 3.24Å; L339-F356 HydrophobicContact CD2-CE2 3.75Å; L339-F356 HydrophobicContact CD2-CZ 4.22Å; L339-V396 HydrophobicContact CB-CG1 4.07Å; L339-V396 HydrophobicContact CB-CG2 4.27Å; L339-L399 HydrophobicContact CD1-CB 3.68Å; L339-L399 HydrophobicContact CD2-CB 4.18Å; L339-L399 HydrophobicContact CD2-CD1 4.07Å; L339-V400 HydrophobicContact CD1-CG2 3.8Å; L339-V424 HydrophobicContact CD2-CB 4.42Å; L339-V424 HydrophobicContact CD2-CG2 4.45Å; L339-F426 HydrophobicContact CD2-CZ 4.47Å
340	G	94	Very high	95.4	Very high	26 Å²	26	45.2 Å²	45.2	27%	0.268	24%	0.244	S	C	.	.	H	α-helix	trans	-55.3	-57	177.6	0	0	0	0	0	111.9	Q336 E337 L338 E344	Q336-G340 PolarHBondContact O-N 3.48Å; Q336-G340 VanDerWaalsContact O-N 3.07Å; E337-G340 PolarHBondContact O-N 3.13Å; L338-G340 VanDerWaalsContact C-N 3.31Å; L338-G340 PolarHBondContact O-N 3.47Å; G340-E344 PolarHBondContact O-N 3.29Å
341	G	91.6	Very high	95.2	Very high	32 Å²	32	42.1 Å²	42.1	33%	0.33	23%	0.228	S	C	.	.	H	α-helix	trans	-68.5	-37.6	178.1	0	0	0	0	0	113.6	E344 R345	G341-E344 PolarHBondContact O-N 3.25Å; G341-R345 WeakPolarHBondContact O-CG 3.45Å; G341-R345 PolarHBondContact O-N 2.97Å
342	L	95.6	Very high	95	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-41	179.1	179	60.7	0	0	0	112.5	L316 D318 L338 L339 R345 M346 V424 F426	L316-L342 HydrophobicContact CB-CD1 3.65Å; D318-L342 PolarHBondContact OD2-N 2.92Å; L338-L342 WeakPolarHBondContact O-CB 3.46Å; L338-L342 PolarHBondContact O-N 3.47Å; L338-L342 VanDerWaalsContact O-N 3.16Å; L339-L342 PolarHBondContact O-N 2.93Å; L342-R345 VanDerWaalsContact CD1-NH2 3.3Å; L342-R345 PolarHBondContact O-N 3.37Å; L342-M346 WeakPolarHBondContact O-CB 3.47Å; L342-M346 PolarHBondContact O-N 3.06Å; L342-V424 HydrophobicContact CD2-CB 4.21Å; L342-V424 HydrophobicContact CD2-CG2 3.79Å; L342-F426 HydrophobicContact CD1-CD2 3.91Å; L342-F426 HydrophobicContact CD1-CE2 4.36Å; L342-F426 HydrophobicContact CD2-CD2 3.83Å; L342-F426 HydrophobicContact CD2-CE2 3.9Å; L342-F426 HydrophobicContact CD2-CG 4.2Å; L342-F426 HydrophobicContact CD2-CZ 4.32Å; L342-F426 HydrophobicContact CG-CD2 3.61Å; L342-F426 HydrophobicContact CG-CE2 3.6Å; L342-F426 HydrophobicContact CG-CG 4.44Å; L342-F426 HydrophobicContact CG-CZ 4.41Å
343	V	96	Very high	94.8	Very high	1 Å²	1	42 Å²	42	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-42.1	177.5	169.5	0	0	0	0	110.8	L339 R345 M346 H347 I392 T395 V396 L399 F426	L339-V343 VanDerWaalsContact O-CB 3.3Å; L339-V343 WeakPolarHBondContact O-CB 3.44Å; L339-V343 WeakPolarHBondContact O-CG2 3.3Å; L339-V343 PolarHBondContact O-N 3.24Å; V343-R345 PolarHBondContact O-N 3.26Å; V343-M346 PolarHBondContact O-N 2.95Å; V343-H347 WeakPolarHBondContact O-CB 3.49Å; V343-H347 PolarHBondContact O-N 2.87Å; V343-I392 HydrophobicContact CB-CG2 4.48Å; V343-I392 HydrophobicContact CG1-CB 4.43Å; V343-I392 HydrophobicContact CG1-CG1 4.3Å; V343-I392 HydrophobicContact CG1-CG2 4.11Å; V343-T395 HydrophobicContact CG1-CG2 4.02Å; V343-T395 HydrophobicContact CG2-CG2 4.09Å; V343-V396 HydrophobicContact CB-CG2 4.3Å; V343-V396 HydrophobicContact CG2-CG2 3.99Å; V343-L399 HydrophobicContact CG2-CD1 3.81Å; V343-F426 HydrophobicContact CG2-CE2 4.24Å; V343-F426 HydrophobicContact CG2-CZ 4.14Å
344	E	93.7	Very high	94.8	Very high	83 Å²	83	41.7 Å²	41.7	39%	0.388	22%	0.216	S	C	.	.	H	α-helix	trans	-61.4	-44.4	176.6	-166.4	-168	154.3	0	0	111.8	G340 G341 M346 H347 K348 I392	G340-E344 PolarHBondContact O-N 3.29Å; G341-E344 PolarHBondContact O-N 3.25Å; E344-M346 VanDerWaalsContact C-N 3.35Å; E344-M346 PolarHBondContact O-N 2.95Å; E344-H347 WeakPolarHBondContact O-CB 3.23Å; E344-H347 PolarHBondContact O-N 2.65Å; E344-K348 PolarHBondContact O-N 2.96Å; E344-K348 WeakPolarHBondContact OE1-CE 3.17Å; E344-K348 IonicContact OE1-NZ 3.7Å; E344-K348 PolarHBondContact OE1-NZ 3.05Å; E344-I392 HydrophobicContact CB-CD1 4.38Å; E344-I392 HydrophobicContact CG-CD1 4.34Å
345	R	93.6	Very high	94.8	Very high	41 Å²	41	40.9 Å²	40.9	16%	0.155	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-39.1	176	-70.1	-178.8	-52.5	167	16.8	112.3	R119 L316 S317 D318 G341 L342 V343 H347 K348 D349	R119-R345 VanDerWaalsContact CZ-NH1 3.32Å; L316-R345 HydrophobicContact CD2-CB 4.16Å; S317-R345 PolarHBondContact O-NH2 2.9Å; D318-R345 VanDerWaalsContact CG-CZ 3.44Å; D318-R345 IonicContact OD1-CZ 2.72Å; D318-R345 IonicContact OD1-NH1 2.75Å; D318-R345 PolarHBondContact OD1-NH1 3.27Å; D318-R345 IonicContact OD1-NH2 2.86Å; D318-R345 PolarHBondContact OD1-NH2 3.38Å; D318-R345 IonicContact OD2-CZ 2.96Å; D318-R345 IonicContact OD2-NE 2.88Å; D318-R345 IonicContact OD2-NH1 3.75Å; D318-R345 IonicContact OD2-NH2 3.6Å; D318-R345 PolarHBondContact OD2-NH2 2.97Å; G341-R345 WeakPolarHBondContact O-CG 3.45Å; G341-R345 PolarHBondContact O-N 2.97Å; L342-R345 VanDerWaalsContact CD1-NH2 3.3Å; L342-R345 PolarHBondContact O-N 3.37Å; V343-R345 PolarHBondContact O-N 3.26Å; R345-H347 VanDerWaalsContact C-N 3.32Å; R345-K348 PolarHBondContact O-N 2.87Å; R345-D349 WeakPolarHBondContact O-CB 3.34Å; R345-D349 PolarHBondContact O-N 3.33Å
346	M	94.5	Very high	94.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-35.6	176.2	-165.3	68.2	-115.8	0	0	111.9	L316 L342 V343 E344 D349 G350 R351 P353 I387 F426 L429	L316-M346 HydrophobicContact CD2-SD 4.12Å; L342-M346 WeakPolarHBondContact O-CB 3.47Å; L342-M346 PolarHBondContact O-N 3.06Å; V343-M346 PolarHBondContact O-N 2.95Å; E344-M346 VanDerWaalsContact C-N 3.35Å; E344-M346 PolarHBondContact O-N 2.95Å; M346-D349 HydrophobicContact CE-CB 4.02Å; M346-D349 VanDerWaalsContact CE-OD1 3.3Å; M346-D349 WeakPolarHBondContact CE-OD1 3.32Å; M346-D349 PolarHBondContact O-N 3.47Å; M346-G350 PolarHBondContact O-N 3.13Å; M346-R351 HydrophobicContact CE-CB 3.94Å; M346-R351 WeakPolarHBondContact CE-O 3.44Å; M346-P353 HydrophobicContact CG-CB 4.45Å; M346-P353 HydrophobicContact CG-CG 3.87Å; M346-P353 HydrophobicContact SD-CB 4.14Å; M346-P353 HydrophobicContact SD-CG 4.19Å; M346-I387 HydrophobicContact CB-CG2 3.74Å; M346-I387 HydrophobicContact CG-CG2 3.55Å; M346-F426 HydrophobicContact CB-CD2 3.87Å; M346-F426 HydrophobicContact CB-CE2 3.97Å; M346-F426 HydrophobicContact CG-CD2 3.78Å; M346-F426 HydrophobicContact CG-CE2 4.14Å; M346-F426 HydrophobicContact SD-CB 4.25Å; M346-F426 HydrophobicContact SD-CD2 4.02Å; M346-L429 HydrophobicContact CE-CD1 4.35Å; M346-L429 HydrophobicContact CE-CD2 3.98Å; M346-L429 HydrophobicContact SD-CD2 3.78Å
347	H	93.9	Very high	94.8	Very high	72 Å²	72	38.7 Å²	38.7	33%	0.333	20%	0.201	S	C	.	.	H	α-helix	trans	-62.3	-48.3	172.4	175.9	59.4	0	0	0	111.3	V343 E344 R345 D349 G350 I387 V388 G390	V343-H347 WeakPolarHBondContact O-CB 3.49Å; V343-H347 PolarHBondContact O-N 2.87Å; E344-H347 WeakPolarHBondContact O-CB 3.23Å; E344-H347 PolarHBondContact O-N 2.65Å; R345-H347 VanDerWaalsContact C-N 3.32Å; H347-D349 VanDerWaalsContact C-N 3.32Å; H347-D349 PolarHBondContact O-N 2.91Å; H347-G350 PolarHBondContact O-N 3.33Å; H347-G350 VanDerWaalsContact O-N 3.14Å; H347-I387 WeakPolarHBondContact CB-O 3.22Å; H347-I387 PolarHBondContact ND1-O 3.26Å; H347-V388 PolarHBondContact CE1-O 3.32Å; H347-V388 PolarHBondContact ND1-O 3.29Å; H347-G390 PolarHBondContact ND1-N 3.37Å
348	K	91.7	Very high	94.9	Very high	147 Å²	147	33 Å²	33	64%	0.639	18%	0.175	S	C	*	.	H	α-helix	trans	-61.3	-36.5	176.3	-74.6	170.6	171.1	165.5	0	113.1	E344 R345 G350	E344-K348 PolarHBondContact O-N 2.96Å; E344-K348 WeakPolarHBondContact OE1-CE 3.17Å; E344-K348 IonicContact OE1-NZ 3.7Å; E344-K348 PolarHBondContact OE1-NZ 3.05Å; R345-K348 PolarHBondContact O-N 2.87Å; K348-G350 VanDerWaalsContact C-N 3.26Å; K348-G350 PolarHBondContact O-N 3.1Å
349	D	92.3	Very high	95	Very high	48 Å²	48	33 Å²	33	26%	0.257	18%	0.175	S	C	.	.	H	α-helix	trans	-66.4	-27.1	176.6	-178.6	-86.1	0	0	0	112.6	L316 R345 M346 H347 R351	L316-D349 HydrophobicContact CD2-CB 4.38Å; R345-D349 WeakPolarHBondContact O-CB 3.34Å; R345-D349 PolarHBondContact O-N 3.33Å; M346-D349 HydrophobicContact CE-CB 4.02Å; M346-D349 VanDerWaalsContact CE-OD1 3.3Å; M346-D349 WeakPolarHBondContact CE-OD1 3.32Å; M346-D349 PolarHBondContact O-N 3.47Å; H347-D349 VanDerWaalsContact C-N 3.32Å; H347-D349 PolarHBondContact O-N 2.91Å; D349-R351 PolarHBondContact O-N 2.91Å; D349-R351 VanDerWaalsContact OD1-CB 3.25Å; D349-R351 WeakPolarHBondContact OD1-CB 3.29Å; D349-R351 WeakPolarHBondContact OD1-CG 3.38Å; D349-R351 IonicContact OD1-CZ 2.91Å; D349-R351 PolarHBondContact OD1-N 3.01Å; D349-R351 IonicContact OD1-NE 3.41Å; D349-R351 PolarHBondContact OD1-NE 3.41Å; D349-R351 IonicContact OD1-NH2 3.78Å; D349-R351 PolarHBondContact OD1-NH2 3.39Å; D349-R351 IonicContact OD2-CZ 3.13Å; D349-R351 IonicContact OD2-NE 3.18Å; D349-R351 IonicContact OD2-NH2 3.87Å; D349-R351 PolarHBondContact OD2-NH2 3.15Å
350	G	91.6	Very high	95	Very high	36 Å²	36	33 Å²	33	37%	0.371	18%	0.175	S	C	.	.			trans	74.1	-10.2	172.6	0	0	0	0	0	115.6	M346 H347 K348	M346-G350 PolarHBondContact O-N 3.13Å; H347-G350 PolarHBondContact O-N 3.33Å; H347-G350 VanDerWaalsContact O-N 3.14Å; K348-G350 VanDerWaalsContact C-N 3.26Å; K348-G350 PolarHBondContact O-N 3.1Å
351	R	92.9	Very high	95.1	Very high	33 Å²	33	32.7 Å²	32.7	13%	0.125	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-78.6	162.2	169.4	-61.8	177.9	-70.6	163.5	0.7	110.5	P313 M346 D349 L429 Q430	P313-R351 VanDerWaalsContact O-CZ 3.3Å; P313-R351 PolarHBondContact O-NH1 3.19Å; P313-R351 PolarHBondContact O-NH2 3.14Å; M346-R351 HydrophobicContact CE-CB 3.94Å; M346-R351 WeakPolarHBondContact CE-O 3.44Å; D349-R351 PolarHBondContact O-N 2.91Å; D349-R351 VanDerWaalsContact OD1-CB 3.25Å; D349-R351 WeakPolarHBondContact OD1-CB 3.29Å; D349-R351 WeakPolarHBondContact OD1-CG 3.38Å; D349-R351 IonicContact OD1-CZ 2.91Å; D349-R351 PolarHBondContact OD1-N 3.01Å; D349-R351 IonicContact OD1-NE 3.41Å; D349-R351 PolarHBondContact OD1-NE 3.41Å; D349-R351 IonicContact OD1-NH2 3.78Å; D349-R351 PolarHBondContact OD1-NH2 3.39Å; D349-R351 IonicContact OD2-CZ 3.13Å; D349-R351 IonicContact OD2-NE 3.18Å; D349-R351 IonicContact OD2-NH2 3.87Å; D349-R351 PolarHBondContact OD2-NH2 3.15Å; R351-L429 HydrophobicContact CB-CB 4.32Å; R351-Q430 WeakPolarHBondContact CA-O 3.39Å; R351-Q430 WeakPolarHBondContact CB-O 3.49Å
352	Q	92.9	Very high	95.1	Very high	32 Å²	32	34.8 Å²	34.8	15%	0.15	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	125.2	175.7	-171.8	178.9	3.9	0	0	110.5	V388 Q430	Q352-V388 HydrophobicContact CB-CG2 4.18Å; Q352-V388 HydrophobicContact CG-CG2 4.47Å; Q352-Q430 PolarHBondContact N-O 2.99Å; Q352-Q430 PolarHBondContact O-N 3.14Å
353	P	95.6	Very high	94.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	138.3	173.4	34.3	-36.8	0	0	0	111	M346 I379 I387 F426 L429	M346-P353 HydrophobicContact CG-CB 4.45Å; M346-P353 HydrophobicContact CG-CG 3.87Å; M346-P353 HydrophobicContact SD-CB 4.14Å; M346-P353 HydrophobicContact SD-CG 4.19Å; P353-I379 HydrophobicContact CB-CD1 3.74Å; P353-I379 HydrophobicContact CG-CD1 3.74Å; P353-I387 HydrophobicContact CG-CD1 3.58Å; P353-F426 HydrophobicContact CB-CB 3.7Å; P353-F426 HydrophobicContact CB-CD1 4.08Å; P353-F426 HydrophobicContact CB-CD2 4.45Å; P353-F426 HydrophobicContact CB-CG 3.84Å; P353-F426 HydrophobicContact CG-CB 4.47Å; P353-F426 HydrophobicContact CG-CD1 4.24Å; P353-F426 HydrophobicContact CG-CD2 4.34Å; P353-F426 HydrophobicContact CG-CG 4.11Å; P353-L429 HydrophobicContact CB-CD2 3.7Å
354	Q	96.1	Very high	94.3	Very high	50 Å²	50	41.3 Å²	41.3	23%	0.234	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-19	178.6	-58.9	-60.3	-32.2	0	0	113	P378 I379 S427 N428 Q430	Q354-P378 WeakPolarHBondContact O-CA 3.17Å; Q354-I379 PolarHBondContact O-N 3.24Å; Q354-S427 PolarHBondContact N-O 3.5Å; Q354-N428 HydrophobicContact CB-CB 3.95Å; Q354-N428 WeakPolarHBondContact CB-O 3.43Å; Q354-N428 WeakPolarHBondContact CG-O 3.34Å; Q354-N428 PolarHBondContact N-O 3.23Å; Q354-Q430 HydrophobicContact CG-CG 3.84Å
355	T	97.7	Very high	93.7	Very high	16 Å²	16	40.9 Å²	40.9	10%	0.098	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.6	-175.8	-58.5	0	0	0	0	110.8	Q376 F426 S427 N428	T355-Q376 HydrophobicContact CG2-CB 4.05Å; T355-Q376 HydrophobicContact CG2-CG 4.33Å; T355-F426 WeakPolarHBondContact O-CA 3.47Å; T355-S427 PolarHBondContact N-O 2.83Å; T355-S427 VanDerWaalsContact N-O 3.13Å; T355-S427 PolarHBondContact O-N 2.94Å; T355-N428 PolarHBondContact OG1-ND2 3.35Å
356	F	98.3	Very high	92.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.8	172	177.6	-110.4	0	0	0	109.5	L339 Q376 A377 I379 L402 A403 L406 V424 C425 F426	L339-F356 HydrophobicContact CD2-CE2 3.75Å; L339-F356 HydrophobicContact CD2-CZ 4.22Å; F356-Q376 CarbonylContact O-C 3.51Å; F356-Q376 WeakPolarHBondContact O-CA 3.43Å; F356-Q376 WeakPolarHBondContact O-CB 3.43Å; F356-A377 PolarHBondContact N-O 2.85Å; F356-A377 PolarHBondContact O-N 3.35Å; F356-I379 HydrophobicContact CB-CD1 4.01Å; F356-I379 HydrophobicContact CB-CG1 3.69Å; F356-L402 HydrophobicContact CB-CD2 4.07Å; F356-L402 HydrophobicContact CD1-CD2 3.86Å; F356-L402 HydrophobicContact CD1-CG 4.07Å; F356-L402 HydrophobicContact CG-CD2 4.29Å; F356-A403 HydrophobicContact CE1-CB 3.72Å; F356-A403 HydrophobicContact CZ-CB 3.97Å; F356-L406 HydrophobicContact CD1-CD1 3.75Å; F356-L406 HydrophobicContact CE1-CD1 3.99Å; F356-V424 HydrophobicContact CE2-CB 3.98Å; F356-V424 HydrophobicContact CE2-CG1 4.19Å; F356-V424 HydrophobicContact CZ-CB 4.27Å; F356-V424 HydrophobicContact CZ-CG1 3.96Å; F356-C425 CarbonylContact C-O 3.59Å; F356-C425 WeakPolarHBondContact CA-O 3.42Å; F356-F426 AromaticContact CD2-CD1 3.87Å; F356-F426 HydrophobicContact CD2-CD1 3.87Å; F356-F426 AromaticContact CD2-CE1 3.62Å; F356-F426 HydrophobicContact CD2-CE1 3.62Å; F356-F426 HydrophobicContact CE2-CE1 4.3Å; F356-F426 HydrophobicContact CG-CE1 4.5Å
357	R	98.6	Very high	91.6	Very high	61 Å²	61	48.8 Å²	48.8	23%	0.23	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.3	178.3	-179.5	170.5	63.8	-112.5	1.5	110.1	R375 Q376 C425	R357-R375 WeakPolarHBondContact CA-O 3.47Å; R357-Q376 HydrophobicContact CB-CB 3.83Å; R357-Q376 HydrophobicContact CG-CB 4.07Å; R357-C425 HydrophobicContact CB-CB 4.27Å; R357-C425 PolarHBondContact N-O 3.42Å; R357-C425 PolarHBondContact NH2-SG 3.01Å; R357-C425 PolarHBondContact O-N 3.49Å
358	L	98.6	Very high	90	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.9	170.1	180	67.8	0	0	0	108.2	I335 S374 R375 L406 F407 M410 I422 V424	I335-L358 HydrophobicContact CD1-CD1 3.89Å; I335-L358 HydrophobicContact CD1-CD2 4.15Å; I335-L358 HydrophobicContact CG1-CD1 4.11Å; L358-S374 CarbonylContact O-C 3.6Å; L358-S374 VanDerWaalsContact O-CA 3.25Å; L358-S374 WeakPolarHBondContact O-CA 3.44Å; L358-S374 WeakPolarHBondContact O-CB 3.45Å; L358-R375 PolarHBondContact N-O 2.94Å; L358-R375 PolarHBondContact O-N 3.3Å; L358-L406 HydrophobicContact CB-CB 4.24Å; L358-L406 HydrophobicContact CB-CD1 4.13Å; L358-L406 HydrophobicContact CD2-CB 4.2Å; L358-F407 HydrophobicContact CD2-CB 3.9Å; L358-M410 HydrophobicContact CB-CE 4.28Å; L358-M410 HydrophobicContact CD2-CE 3.68Å; L358-M410 HydrophobicContact CG-CE 3.84Å; L358-I422 HydrophobicContact CD1-CG2 4.03Å; L358-V424 HydrophobicContact CD1-CG1 3.97Å
359	T	98.3	Very high	88.9	Confident	14 Å²	14	51.4 Å²	51.4	9%	0.086	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.6	176.7	-50.6	0	0	0	0	109.1	R372 E373 S374 I422 N423	T359-R372 HydrophobicContact CG2-CB 4.03Å; T359-E373 CarbonylContact C-O 3.21Å; T359-E373 VanDerWaalsContact CA-O 3.26Å; T359-E373 WeakPolarHBondContact CA-O 3.42Å; T359-E373 WeakPolarHBondContact CG2-O 3.09Å; T359-S374 WeakPolarHBondContact OG1-CB 3.44Å; T359-I422 CarbonylContact O-C 3.49Å; T359-I422 WeakPolarHBondContact O-CA 3.18Å; T359-N423 PolarHBondContact N-O 2.95Å; T359-N423 PolarHBondContact O-N 3.34Å
360	I	97.2	Very high	88	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	158.3	175.7	64.1	173.9	0	0	0	110.4	R372 E373 M410 V411 L419 L421 I422	I360-R372 WeakPolarHBondContact O-CA 3.23Å; I360-E373 HydrophobicContact CG1-CB 4.15Å; I360-E373 PolarHBondContact N-O 3.21Å; I360-E373 PolarHBondContact O-N 3.15Å; I360-M410 HydrophobicContact CD1-CB 3.9Å; I360-M410 HydrophobicContact CD1-CE 4.33Å; I360-M410 HydrophobicContact CD1-SD 4.33Å; I360-M410 HydrophobicContact CG1-CE 4.26Å; I360-M410 HydrophobicContact CG1-SD 4.15Å; I360-M410 HydrophobicContact CG2-CE 4.05Å; I360-V411 HydrophobicContact CD1-CG2 3.51Å; I360-L419 HydrophobicContact CB-CD2 4.43Å; I360-L419 HydrophobicContact CD1-CD2 4.03Å; I360-L419 HydrophobicContact CG2-CD1 4.39Å; I360-L421 WeakPolarHBondContact CA-O 3.42Å; I360-I422 HydrophobicContact CG2-CG1 4.44Å
361	R	95.6	Very high	87.6	Confident	20 Å²	20	57.6 Å²	57.6	8%	0.075	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.4	163.2	-173.6	170.2	58.6	-164.5	-5.3	108.9	W369 S371 L419 T420 L421	R361-W369 VanDerWaalsContact CD-O 3.31Å; R361-W369 WeakPolarHBondContact CD-O 3.48Å; R361-W369 PolarHBondContact NH1-O 3.42Å; R361-S371 WeakPolarHBondContact CG-O 3.32Å; R361-L419 CarbonylContact O-C 3.56Å; R361-L419 VanDerWaalsContact O-CA 3.32Å; R361-L419 WeakPolarHBondContact O-CA 3.48Å; R361-T420 WeakPolarHBondContact CG-OG1 3.41Å; R361-T420 PolarHBondContact NE-OG1 3.06Å; R361-T420 PolarHBondContact O-N 3.49Å; R361-T420 PolarHBondContact O-OG1 2.89Å; R361-L421 HydrophobicContact CB-CB 3.73Å; R361-L421 PolarHBondContact N-O 3.42Å
362	R	92.8	Very high	87.6	Confident	75 Å²	75	61.8 Å²	61.8	28%	0.283	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	148.2	171.1	-68	173.8	177.3	-99.6	7	109.6	S364 E373 M410 H418 L419	R362-S364 PolarHBondContact O-N 3.44Å; R362-E373 WeakPolarHBondContact CD-OE1 3.46Å; R362-E373 IonicContact NE-OE1 3.59Å; R362-E373 IonicContact NE-OE2 3.8Å; R362-M410 PolarHBondContact NH2-O 2.9Å; R362-H418 WeakPolarHBondContact CA-O 2.98Å; R362-L419 HydrophobicContact CG-CD2 3.86Å
363	F	90.8	Very high	87.7	Confident	107 Å²	107	63.2 Å²	63.2	47%	0.469	31%	0.307	S	S	.	.			trans	-63.7	135	166.7	178.9	-101	0	0	0	109.5	H418 T420	F363-H418 HydrophobicContact CB-CB 4.05Å; F363-H418 VanDerWaalsContact CB-CG 3.49Å; F363-H418 WeakPolarHBondContact CB-ND1 3.44Å; F363-H418 AromaticContact CD1-ND1 3.76Å; F363-H418 AromaticContact CD2-CE1 3.75Å; F363-H418 AromaticContact CG-CE1 3.5Å; F363-H418 VanDerWaalsContact CG-CE1 3.5Å; F363-H418 WeakPolarHBondContact CG-CE1 3.31Å; F363-H418 AromaticContact CG-ND1 3.54Å; F363-H418 PolarHBondContact N-O 3.24Å; F363-T420 HydrophobicContact CB-CG2 3.88Å; F363-T420 HydrophobicContact CD2-CG2 4.2Å
364	S	84.1	Confident	87.8	Confident	32 Å²	32	65.7 Å²	65.7	22%	0.224	33%	0.325	C	S	.	.			trans	-138.9	132.7	172.7	171.8	0	0	0	0	108.5	R362 T366 N367 K368	R362-S364 PolarHBondContact O-N 3.44Å; S364-T366 VanDerWaalsContact C-N 3.3Å; S364-T366 PolarHBondContact OG-N 2.9Å; S364-T366 PolarHBondContact OG-OG1 2.92Å; S364-N367 PolarHBondContact OG-N 3.07Å; S364-N367 VanDerWaalsContact OG-N 3.12Å; S364-K368 VanDerWaalsContact O-CA 3.31Å; S364-K368 WeakPolarHBondContact O-CA 3.46Å; S364-K368 VanDerWaalsContact O-CG 3.29Å; S364-K368 WeakPolarHBondContact O-CG 3.11Å; S364-K368 PolarHBondContact O-N 3.22Å
365	A	80.8	Confident	87.9	Confident	74 Å²	74	68.8 Å²	68.8	61%	0.612	33%	0.334	S	S	*	.	S	Bend	trans	-68.5	-32.5	177.7	0	0	0	0	0	112.1
366	T	75.6	Confident	87.9	Confident	136 Å²	136	73.5 Å²	73.5	83%	0.834	36%	0.355	S	S	*	.	S	Bend	trans	-94.3	-30	-174.9	54.9	0	0	0	0	113.2	S364	S364-T366 VanDerWaalsContact C-N 3.3Å; S364-T366 PolarHBondContact OG-N 2.9Å; S364-T366 PolarHBondContact OG-OG1 2.92Å
367	N	67.2	Low	87.9	Confident	71 Å²	71	74.4 Å²	74.4	38%	0.38	36%	0.363	S	S	.	.	S	Bend	trans	-130.7	62.6	-177.1	-160.2	-21.1	0	0	0	110.4	S364 W369 F370	S364-N367 PolarHBondContact OG-N 3.07Å; S364-N367 VanDerWaalsContact OG-N 3.12Å; N367-W369 PolarHBondContact O-N 2.78Å; N367-F370 WeakPolarHBondContact OD1-CB 3.08Å; N367-F370 WeakPolarHBondContact OD1-CD2 3.34Å
368	K	62.2	Low	87.8	Confident	116 Å²	116	76.4 Å²	76.4	50%	0.504	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-27.2	-165.8	-70.3	178	-179.2	175	0	114.5	S364	S364-K368 VanDerWaalsContact O-CA 3.31Å; S364-K368 WeakPolarHBondContact O-CA 3.46Å; S364-K368 VanDerWaalsContact O-CG 3.29Å; S364-K368 WeakPolarHBondContact O-CG 3.11Å; S364-K368 PolarHBondContact O-N 3.22Å
369	W	68.1	Low	87.7	Confident	158 Å²	158	76.9 Å²	76.9	60%	0.598	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	-20.8	-165.3	-49.4	110	0	0	0	116.5	R361 N367	R361-W369 VanDerWaalsContact CD-O 3.31Å; R361-W369 WeakPolarHBondContact CD-O 3.48Å; R361-W369 PolarHBondContact NH1-O 3.42Å; N367-W369 PolarHBondContact O-N 2.78Å
370	F	72.8	Confident	87.4	Confident	159 Å²	159	79.7 Å²	79.7	70%	0.697	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-17.9	-166.4	-55.8	-74.3	0	0	0	115.4	N367 R372	N367-F370 WeakPolarHBondContact OD1-CB 3.08Å; N367-F370 WeakPolarHBondContact OD1-CD2 3.34Å; F370-R372 PolarHBondContact O-N 2.89Å
371	S	83.9	Confident	86.9	Confident	54 Å²	54	84.2 Å²	84.2	38%	0.378	44%	0.436	S	S	.	.			trans	-83.7	85.5	-174.5	-167.9	0	0	0	0	112.8	R361	R361-S371 WeakPolarHBondContact CG-O 3.32Å
372	R	92.4	Very high	86.6	Confident	121 Å²	121	85.1 Å²	85.1	46%	0.457	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	137.7	173.3	-62.3	-173.1	-175	-152.5	0.9	111.1	E319 T359 I360 F370	E319-R372 IonicContact OE2-CZ 2.83Å; E319-R372 IonicContact OE2-NH1 2.7Å; E319-R372 PolarHBondContact OE2-NH1 2.79Å; E319-R372 IonicContact OE2-NH2 3.99Å; T359-R372 HydrophobicContact CG2-CB 4.03Å; I360-R372 WeakPolarHBondContact O-CA 3.23Å; F370-R372 PolarHBondContact O-N 2.89Å
373	E	94.5	Very high	86.4	Confident	62 Å²	62	81.9 Å²	81.9	29%	0.29	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.6	174.8	-68.2	170.2	-142.2	0	0	109.7	T359 I360 R362	T359-E373 CarbonylContact C-O 3.21Å; T359-E373 VanDerWaalsContact CA-O 3.26Å; T359-E373 WeakPolarHBondContact CA-O 3.42Å; T359-E373 WeakPolarHBondContact CG2-O 3.09Å; I360-E373 HydrophobicContact CG1-CB 4.15Å; I360-E373 PolarHBondContact N-O 3.21Å; I360-E373 PolarHBondContact O-N 3.15Å; R362-E373 WeakPolarHBondContact CD-OE1 3.46Å; R362-E373 IonicContact NE-OE1 3.59Å; R362-E373 IonicContact NE-OE2 3.8Å
374	S	97.6	Very high	86.3	Confident	53 Å²	53	76.8 Å²	76.8	37%	0.371	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	153.6	178.2	67.8	0	0	0	0	113.6	L358 T359	L358-S374 CarbonylContact O-C 3.6Å; L358-S374 VanDerWaalsContact O-CA 3.25Å; L358-S374 WeakPolarHBondContact O-CA 3.44Å; L358-S374 WeakPolarHBondContact O-CB 3.45Å; T359-S374 WeakPolarHBondContact OG1-CB 3.44Å
375	R	98.3	Very high	86.4	Confident	114 Å²	114	80.2 Å²	80.2	43%	0.43	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	149.1	167.9	-65.9	-67.4	-179.2	-88.9	-1.1	109	R357 L358 L406 K409 M410	R357-R375 WeakPolarHBondContact CA-O 3.47Å; L358-R375 PolarHBondContact N-O 2.94Å; L358-R375 PolarHBondContact O-N 3.3Å; R375-L406 HydrophobicContact CB-CB 4.24Å; R375-L406 HydrophobicContact CB-CD2 4Å; R375-K409 HydrophobicContact CG-CB 4.44Å; R375-M410 HydrophobicContact CB-CG 4.23Å; R375-M410 HydrophobicContact CB-SD 4.09Å; R375-M410 HydrophobicContact CG-CG 3.3Å; R375-M410 HydrophobicContact CG-SD 3.66Å
376	Q	98.2	Very high	86.8	Confident	115 Å²	115	80 Å²	80	54%	0.537	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	155.6	-179.7	66.2	-175.5	33.1	0	0	111.6	T355 F356 R357	T355-Q376 HydrophobicContact CG2-CB 4.05Å; T355-Q376 HydrophobicContact CG2-CG 4.33Å; F356-Q376 CarbonylContact O-C 3.51Å; F356-Q376 WeakPolarHBondContact O-CA 3.43Å; F356-Q376 WeakPolarHBondContact O-CB 3.43Å; R357-Q376 HydrophobicContact CB-CB 3.83Å; R357-Q376 HydrophobicContact CG-CB 4.07Å
377	A	97.8	Very high	87.5	Confident	20 Å²	20	73.6 Å²	73.6	17%	0.165	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	154.8	176.6	0	0	0	0	0	110.9	F356 L402 L406	F356-A377 PolarHBondContact N-O 2.85Å; F356-A377 PolarHBondContact O-N 3.35Å; A377-L402 HydrophobicContact CB-CD1 3.95Å; A377-L406 HydrophobicContact CB-CD1 4.49Å; A377-L406 HydrophobicContact CB-CD2 3.97Å
378	P	97.7	Very high	88.4	Confident	102 Å²	102	71.9 Å²	71.9	66%	0.662	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	144.1	169.8	27.8	-34.4	0	0	0	110.6	Q354	Q354-P378 WeakPolarHBondContact O-CA 3.17Å
379	I	95.9	Very high	89.5	Confident	11 Å²	11	70.5 Å²	70.5	6%	0.056	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-82.3	126.3	173.3	-64.1	173.9	0	0	0	108	P353 Q354 F356 S381 V383 F426	P353-I379 HydrophobicContact CB-CD1 3.74Å; P353-I379 HydrophobicContact CG-CD1 3.74Å; Q354-I379 PolarHBondContact O-N 3.24Å; F356-I379 HydrophobicContact CB-CD1 4.01Å; F356-I379 HydrophobicContact CB-CG1 3.69Å; I379-S381 PolarHBondContact O-N 3.16Å; I379-V383 HydrophobicContact CG2-CB 3.89Å; I379-V383 HydrophobicContact CG2-CG1 3.91Å; I379-F426 HydrophobicContact CD1-CD1 3.66Å; I379-F426 HydrophobicContact CD1-CE1 3.82Å
380	P	92.9	Very high	90.1	Very high	73 Å²	73	64.4 Å²	64.4	47%	0.474	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-55.5	136.8	174.3	-24.9	34.1	0	0	0	111.1	G382 V383 G384	P380-G382 VanDerWaalsContact C-N 3.25Å; P380-G382 PolarHBondContact O-N 2.83Å; P380-G382 VanDerWaalsContact O-N 3.15Å; P380-V383 HydrophobicContact CB-CB 4.46Å; P380-V383 HydrophobicContact CB-CG2 3.99Å; P380-V383 HydrophobicContact CG-CG2 4.14Å; P380-V383 WeakPolarHBondContact O-CA 3.4Å; P380-V383 WeakPolarHBondContact O-CB 3.17Å; P380-V383 PolarHBondContact O-N 2.97Å; P380-G384 PolarHBondContact O-N 3.42Å
381	S	85.9	Confident	90.8	Very high	95 Å²	95	60.5 Å²	60.5	66%	0.664	35%	0.346	S	S	*	.	H	α-helix	trans	-53.9	-40.6	-173.8	55.3	0	0	0	0	113.2	I379 V383 G384 Q385	I379-S381 PolarHBondContact O-N 3.16Å; S381-V383 PolarHBondContact O-N 2.83Å; S381-G384 PolarHBondContact O-N 3.14Å; S381-Q385 WeakPolarHBondContact O-CG 3.41Å; S381-Q385 PolarHBondContact O-N 2.98Å
382	G	88.3	Confident	91	Very high	39 Å²	39	60.6 Å²	60.6	40%	0.402	34%	0.342	S	S	.	.	H	α-helix	trans	-61.7	-38.8	175.5	0	0	0	0	0	113.7	P380 K386	P380-G382 VanDerWaalsContact C-N 3.25Å; P380-G382 PolarHBondContact O-N 2.83Å; P380-G382 VanDerWaalsContact O-N 3.15Å; G382-K386 VanDerWaalsContact O-CG 3.29Å; G382-K386 WeakPolarHBondContact O-CG 3.44Å; G382-K386 PolarHBondContact O-N 2.96Å
383	V	89.9	Confident	90.9	Very high	7 Å²	7	62.8 Å²	62.8	4%	0.042	36%	0.357	C	S	.	.	H	α-helix	trans	-66.7	-46	175.5	178.4	0	0	0	0	110	I379 P380 S381 Q385 K386 I387 T395 Q398 L399	I379-V383 HydrophobicContact CG2-CB 3.89Å; I379-V383 HydrophobicContact CG2-CG1 3.91Å; P380-V383 HydrophobicContact CB-CB 4.46Å; P380-V383 HydrophobicContact CB-CG2 3.99Å; P380-V383 HydrophobicContact CG-CG2 4.14Å; P380-V383 WeakPolarHBondContact O-CA 3.4Å; P380-V383 WeakPolarHBondContact O-CB 3.17Å; P380-V383 PolarHBondContact O-N 2.97Å; S381-V383 PolarHBondContact O-N 2.83Å; V383-Q385 VanDerWaalsContact C-N 3.29Å; V383-Q385 PolarHBondContact O-N 3.06Å; V383-K386 PolarHBondContact O-N 3.19Å; V383-K386 VanDerWaalsContact O-N 3.08Å; V383-I387 HydrophobicContact CG1-CD1 4.43Å; V383-I387 WeakPolarHBondContact O-CG1 3.19Å; V383-I387 PolarHBondContact O-N 3.36Å; V383-T395 HydrophobicContact CG1-CG2 4.23Å; V383-Q398 HydrophobicContact CG2-CB 4.05Å; V383-L399 HydrophobicContact CG1-CD2 3.96Å; V383-L399 HydrophobicContact CG1-CG 4.01Å
384	G	88.3	Confident	90.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-36.4	-179.6	0	0	0	0	0	113	P380 S381 V388	P380-G384 PolarHBondContact O-N 3.42Å; S381-G384 PolarHBondContact O-N 3.14Å; G384-V388 PolarHBondContact O-N 3.03Å
385	Q	86.3	Confident	90.5	Very high	105 Å²	105	59.9 Å²	59.9	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-68.3	-37.7	173.7	-68.5	-62.8	-42.7	0	0	112.3	S381 V383 V388 S389	S381-Q385 WeakPolarHBondContact O-CG 3.41Å; S381-Q385 PolarHBondContact O-N 2.98Å; V383-Q385 VanDerWaalsContact C-N 3.29Å; V383-Q385 PolarHBondContact O-N 3.06Å; Q385-V388 PolarHBondContact O-N 3.24Å; Q385-S389 PolarHBondContact O-N 3.02Å; Q385-S389 PolarHBondContact O-OG 3.47Å
386	K	89.6	Confident	90.4	Very high	69 Å²	69	55 Å²	55	30%	0.3	32%	0.322	S	S	.	.	H	α-helix	trans	-66.9	-34.1	177.4	-70.7	173.9	178.2	-171.8	0	113.4	G382 V383 V388 S389 G390 N391 D394 T395	G382-K386 VanDerWaalsContact O-CG 3.29Å; G382-K386 WeakPolarHBondContact O-CG 3.44Å; G382-K386 PolarHBondContact O-N 2.96Å; V383-K386 PolarHBondContact O-N 3.19Å; V383-K386 VanDerWaalsContact O-N 3.08Å; K386-V388 VanDerWaalsContact C-N 3.31Å; K386-S389 WeakPolarHBondContact CA-OG 3.36Å; K386-S389 PolarHBondContact O-N 2.7Å; K386-S389 PolarHBondContact O-OG 3.34Å; K386-G390 PolarHBondContact O-N 3.09Å; K386-N391 PolarHBondContact O-N 3.43Å; K386-D394 VanDerWaalsContact CD-OD2 3.32Å; K386-D394 WeakPolarHBondContact CD-OD2 3.29Å; K386-D394 WeakPolarHBondContact CE-OD2 3.45Å; K386-D394 IonicContact NZ-OD2 3.68Å; K386-D394 PolarHBondContact NZ-OD2 3.28Å; K386-T395 VanDerWaalsContact CB-OG1 3.22Å; K386-T395 WeakPolarHBondContact CB-OG1 3.33Å
387	I	89.4	Confident	90.3	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-56.4	-49.9	170.3	-66.6	167.7	0	0	0	109.4	M346 H347 P353 V383 G390 T395 L399 F426	M346-I387 HydrophobicContact CB-CG2 3.74Å; M346-I387 HydrophobicContact CG-CG2 3.55Å; H347-I387 WeakPolarHBondContact CB-O 3.22Å; H347-I387 PolarHBondContact ND1-O 3.26Å; P353-I387 HydrophobicContact CG-CD1 3.58Å; V383-I387 HydrophobicContact CG1-CD1 4.43Å; V383-I387 WeakPolarHBondContact O-CG1 3.19Å; V383-I387 PolarHBondContact O-N 3.36Å; I387-G390 PolarHBondContact O-N 3.41Å; I387-T395 HydrophobicContact CB-CG2 4.38Å; I387-T395 HydrophobicContact CD1-CG2 4.23Å; I387-T395 HydrophobicContact CG1-CG2 3.29Å; I387-L399 HydrophobicContact CD1-CD1 4.44Å; I387-F426 HydrophobicContact CD1-CE1 4.36Å; I387-F426 HydrophobicContact CD1-CE2 4.38Å; I387-F426 HydrophobicContact CD1-CZ 3.97Å
388	V	86.8	Confident	90.2	Very high	35 Å²	35	54.4 Å²	54.4	21%	0.212	32%	0.323	C	S	.	.	H	α-helix	trans	-71.2	-33.4	-177.5	-179	0	0	0	0	111.7	H347 Q352 G384 Q385 K386 G390	H347-V388 PolarHBondContact CE1-O 3.32Å; H347-V388 PolarHBondContact ND1-O 3.29Å; Q352-V388 HydrophobicContact CB-CG2 4.18Å; Q352-V388 HydrophobicContact CG-CG2 4.47Å; G384-V388 PolarHBondContact O-N 3.03Å; Q385-V388 PolarHBondContact O-N 3.24Å; K386-V388 VanDerWaalsContact C-N 3.31Å; V388-G390 VanDerWaalsContact C-N 3.26Å; V388-G390 PolarHBondContact O-N 3.31Å
389	S	85.5	Confident	90.1	Very high	88 Å²	88	49.6 Å²	49.6	62%	0.615	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-2.4	178.9	76.2	0	0	0	0	114.6	Q385 K386	Q385-S389 PolarHBondContact O-N 3.02Å; Q385-S389 PolarHBondContact O-OG 3.47Å; K386-S389 WeakPolarHBondContact CA-OG 3.36Å; K386-S389 PolarHBondContact O-N 2.7Å; K386-S389 PolarHBondContact O-OG 3.34Å
390	G	81.3	Confident	90.2	Very high	30 Å²	30	50 Å²	50	31%	0.309	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	17.1	174.9	0	0	0	0	0	115.3	H347 K386 I387 V388 I392	H347-G390 PolarHBondContact ND1-N 3.37Å; K386-G390 PolarHBondContact O-N 3.09Å; I387-G390 PolarHBondContact O-N 3.41Å; V388-G390 VanDerWaalsContact C-N 3.26Å; V388-G390 PolarHBondContact O-N 3.31Å; G390-I392 PolarHBondContact O-N 3.35Å; G390-I392 VanDerWaalsContact O-N 3.13Å
391	N	86.7	Confident	90.4	Very high	76 Å²	76	52.3 Å²	52.3	41%	0.406	30%	0.303	S	S	.	.			trans	-85.8	80.4	174.5	-170.1	-20.6	0	0	0	110.1	K386 D394 T395	K386-N391 PolarHBondContact O-N 3.43Å; N391-D394 WeakPolarHBondContact OD1-CB 3.48Å; N391-T395 WeakPolarHBondContact O-CB 3.32Å; N391-T395 PolarHBondContact O-N 2.96Å; N391-T395 PolarHBondContact O-OG1 3.34Å
392	I	87.9	Confident	91	Very high	57 Å²	57	49.1 Å²	49.1	29%	0.292	28%	0.278	S	S	.	.	H	α-helix	trans	-67.7	-52.2	-167.4	-58.6	175.3	0	0	0	112.1	V343 E344 G390 D394 T395 V396	V343-I392 HydrophobicContact CB-CG2 4.48Å; V343-I392 HydrophobicContact CG1-CB 4.43Å; V343-I392 HydrophobicContact CG1-CG1 4.3Å; V343-I392 HydrophobicContact CG1-CG2 4.11Å; E344-I392 HydrophobicContact CB-CD1 4.38Å; E344-I392 HydrophobicContact CG-CD1 4.34Å; G390-I392 PolarHBondContact O-N 3.35Å; G390-I392 VanDerWaalsContact O-N 3.13Å; I392-D394 PolarHBondContact O-N 3.03Å; I392-T395 WeakPolarHBondContact O-CB 3.33Å; I392-T395 PolarHBondContact O-N 2.76Å; I392-V396 HydrophobicContact CG2-CG2 4.05Å; I392-V396 WeakPolarHBondContact O-CB 3.43Å; I392-V396 VanDerWaalsContact O-CG2 3.26Å; I392-V396 WeakPolarHBondContact O-CG2 3.31Å; I392-V396 PolarHBondContact O-N 2.96Å
393	E	90.2	Very high	91.4	Very high	166 Å²	166	47.2 Å²	47.2	78%	0.776	26%	0.259	S	S	*	.	H	α-helix	trans	-63.2	-47.2	-170.5	-65.1	-175.9	173.8	0	0	113.4	T395 V396 S397	E393-T395 VanDerWaalsContact C-N 3.34Å; E393-V396 PolarHBondContact O-N 2.82Å; E393-S397 PolarHBondContact O-N 2.72Å; E393-S397 PolarHBondContact O-OG 3.01Å
394	D	90.8	Very high	91.8	Very high	55 Å²	55	47.4 Å²	47.4	29%	0.294	26%	0.262	S	S	.	.	H	α-helix	trans	-66.6	-38.4	178.3	173.4	45.6	0	0	0	111.4	K386 N391 I392 S397 Q398	K386-D394 VanDerWaalsContact CD-OD2 3.32Å; K386-D394 WeakPolarHBondContact CD-OD2 3.29Å; K386-D394 WeakPolarHBondContact CE-OD2 3.45Å; K386-D394 IonicContact NZ-OD2 3.68Å; K386-D394 PolarHBondContact NZ-OD2 3.28Å; N391-D394 WeakPolarHBondContact OD1-CB 3.48Å; I392-D394 PolarHBondContact O-N 3.03Å; D394-S397 PolarHBondContact O-N 3.33Å; D394-Q398 WeakPolarHBondContact O-CG 3.46Å; D394-Q398 PolarHBondContact O-N 2.74Å; D394-Q398 PolarHBondContact O-NE2 2.82Å; D394-Q398 PolarHBondContact OD1-NE2 2.99Å; D394-Q398 PolarHBondContact OD2-NE2 3.49Å
395	T	93.5	Very high	92.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-48.5	175.9	-66	0	0	0	0	111.6	V343 V383 K386 I387 N391 I392 E393 S397 Q398 L399	V343-T395 HydrophobicContact CG1-CG2 4.02Å; V343-T395 HydrophobicContact CG2-CG2 4.09Å; V383-T395 HydrophobicContact CG1-CG2 4.23Å; K386-T395 VanDerWaalsContact CB-OG1 3.22Å; K386-T395 WeakPolarHBondContact CB-OG1 3.33Å; I387-T395 HydrophobicContact CB-CG2 4.38Å; I387-T395 HydrophobicContact CD1-CG2 4.23Å; I387-T395 HydrophobicContact CG1-CG2 3.29Å; N391-T395 WeakPolarHBondContact O-CB 3.32Å; N391-T395 PolarHBondContact O-N 2.96Å; N391-T395 PolarHBondContact O-OG1 3.34Å; I392-T395 WeakPolarHBondContact O-CB 3.33Å; I392-T395 PolarHBondContact O-N 2.76Å; E393-T395 VanDerWaalsContact C-N 3.34Å; T395-S397 VanDerWaalsContact C-N 3.29Å; T395-S397 PolarHBondContact O-N 3.39Å; T395-Q398 PolarHBondContact O-N 2.93Å; T395-L399 HydrophobicContact CG2-CD1 3.84Å; T395-L399 HydrophobicContact CG2-CG 4.49Å; T395-L399 WeakPolarHBondContact O-CB 3.49Å; T395-L399 WeakPolarHBondContact O-CG 3.45Å; T395-L399 PolarHBondContact O-N 3.42Å
396	V	96	Very high	92.8	Very high	11 Å²	11	49.5 Å²	49.5	7%	0.067	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-45.5	177.2	169.1	0	0	0	0	109.7	Q336 L339 V343 I392 E393 Q398 L399 V400	Q336-V396 HydrophobicContact CG-CG1 3.78Å; L339-V396 HydrophobicContact CB-CG1 4.07Å; L339-V396 HydrophobicContact CB-CG2 4.27Å; V343-V396 HydrophobicContact CB-CG2 4.3Å; V343-V396 HydrophobicContact CG2-CG2 3.99Å; I392-V396 HydrophobicContact CG2-CG2 4.05Å; I392-V396 WeakPolarHBondContact O-CB 3.43Å; I392-V396 VanDerWaalsContact O-CG2 3.26Å; I392-V396 WeakPolarHBondContact O-CG2 3.31Å; I392-V396 PolarHBondContact O-N 2.96Å; E393-V396 PolarHBondContact O-N 2.82Å; V396-Q398 PolarHBondContact O-N 2.9Å; V396-L399 PolarHBondContact O-N 2.91Å; V396-L399 VanDerWaalsContact O-N 3.13Å; V396-V400 HydrophobicContact CG1-CG2 4.22Å; V396-V400 VanDerWaalsContact O-CG2 3.31Å; V396-V400 WeakPolarHBondContact O-CG2 3.29Å; V396-V400 PolarHBondContact O-N 3.14Å
397	S	95.1	Very high	93.2	Very high	65 Å²	65	46.2 Å²	46.2	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-57.9	-45.4	178.5	-59.9	0	0	0	0	112.5	E393 D394 T395 L399 V400 L401	E393-S397 PolarHBondContact O-N 2.72Å; E393-S397 PolarHBondContact O-OG 3.01Å; D394-S397 PolarHBondContact O-N 3.33Å; T395-S397 VanDerWaalsContact C-N 3.29Å; T395-S397 PolarHBondContact O-N 3.39Å; S397-L399 PolarHBondContact O-N 3.27Å; S397-V400 PolarHBondContact O-N 3.28Å; S397-L401 PolarHBondContact O-N 2.8Å
398	Q	95.6	Very high	93.5	Very high	57 Å²	57	51.5 Å²	51.5	27%	0.266	28%	0.28	S	S	.	.	H	α-helix	trans	-66.8	-35.5	176.8	-72.2	171.9	61.9	0	0	112.7	V383 D394 T395 V396 L401 L402	V383-Q398 HydrophobicContact CG2-CB 4.05Å; D394-Q398 WeakPolarHBondContact O-CG 3.46Å; D394-Q398 PolarHBondContact O-N 2.74Å; D394-Q398 PolarHBondContact O-NE2 2.82Å; D394-Q398 PolarHBondContact OD1-NE2 2.99Å; D394-Q398 PolarHBondContact OD2-NE2 3.49Å; T395-Q398 PolarHBondContact O-N 2.93Å; V396-Q398 PolarHBondContact O-N 2.9Å; Q398-L401 PolarHBondContact O-N 3.4Å; Q398-L402 PolarHBondContact O-N 3.37Å
399	L	97	Very high	94	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-73.1	-34.1	177.3	-72.3	170.8	0	0	0	112.7	L339 V343 V383 I387 T395 V396 S397 L401 L402 A403 F426	L339-L399 HydrophobicContact CD1-CB 3.68Å; L339-L399 HydrophobicContact CD2-CB 4.18Å; L339-L399 HydrophobicContact CD2-CD1 4.07Å; V343-L399 HydrophobicContact CG2-CD1 3.81Å; V383-L399 HydrophobicContact CG1-CD2 3.96Å; V383-L399 HydrophobicContact CG1-CG 4.01Å; I387-L399 HydrophobicContact CD1-CD1 4.44Å; T395-L399 HydrophobicContact CG2-CD1 3.84Å; T395-L399 HydrophobicContact CG2-CG 4.49Å; T395-L399 WeakPolarHBondContact O-CB 3.49Å; T395-L399 WeakPolarHBondContact O-CG 3.45Å; T395-L399 PolarHBondContact O-N 3.42Å; V396-L399 PolarHBondContact O-N 2.91Å; V396-L399 VanDerWaalsContact O-N 3.13Å; S397-L399 PolarHBondContact O-N 3.27Å; L399-L401 VanDerWaalsContact C-N 3.3Å; L399-L401 PolarHBondContact O-N 3.45Å; L399-L402 HydrophobicContact CD2-CD2 4.49Å; L399-L402 WeakPolarHBondContact O-CB 3.41Å; L399-L402 PolarHBondContact O-N 3.35Å; L399-A403 WeakPolarHBondContact O-CB 3.29Å; L399-A403 PolarHBondContact O-N 2.87Å; L399-F426 HydrophobicContact CD1-CE1 4.03Å; L399-F426 HydrophobicContact CD1-CZ 3.61Å; L399-F426 HydrophobicContact CD2-CE1 4.24Å
400	V	97.7	Very high	94.5	Very high	21 Å²	21	53.3 Å²	53.3	13%	0.127	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-41.3	172.5	170.6	0	0	0	0	110.3	I335 Q336 L339 V396 S397 L402 A403 G404	I335-V400 HydrophobicContact CG2-CG2 4.48Å; Q336-V400 HydrophobicContact CB-CG2 3.8Å; Q336-V400 HydrophobicContact CG-CG2 4.17Å; L339-V400 HydrophobicContact CD1-CG2 3.8Å; V396-V400 HydrophobicContact CG1-CG2 4.22Å; V396-V400 VanDerWaalsContact O-CG2 3.31Å; V396-V400 WeakPolarHBondContact O-CG2 3.29Å; V396-V400 PolarHBondContact O-N 3.14Å; S397-V400 PolarHBondContact O-N 3.28Å; V400-L402 VanDerWaalsContact C-N 3.35Å; V400-L402 PolarHBondContact O-N 3.21Å; V400-A403 PolarHBondContact O-N 3.17Å; V400-G404 PolarHBondContact O-N 3.15Å
401	L	97	Very high	95.2	Very high	120 Å²	120	52 Å²	52	63%	0.628	26%	0.26	S	S	*	.	H	α-helix	trans	-62.3	-40.9	174.3	-66.1	174.6	0	0	0	112.3	S397 Q398 L399 G404 K405	S397-L401 PolarHBondContact O-N 2.8Å; Q398-L401 PolarHBondContact O-N 3.4Å; L399-L401 VanDerWaalsContact C-N 3.3Å; L399-L401 PolarHBondContact O-N 3.45Å; L401-G404 PolarHBondContact O-N 2.65Å; L401-K405 PolarHBondContact O-N 3.37Å
402	L	97.5	Very high	95.5	Very high	28 Å²	28	53 Å²	53	15%	0.147	27%	0.265	C	S	.	.	H	α-helix	trans	-65.5	-44.6	175.5	-178.3	60	0	0	0	111.4	F356 A377 Q398 L399 V400 G404 K405 L406	F356-L402 HydrophobicContact CB-CD2 4.07Å; F356-L402 HydrophobicContact CD1-CD2 3.86Å; F356-L402 HydrophobicContact CD1-CG 4.07Å; F356-L402 HydrophobicContact CG-CD2 4.29Å; A377-L402 HydrophobicContact CB-CD1 3.95Å; Q398-L402 PolarHBondContact O-N 3.37Å; L399-L402 HydrophobicContact CD2-CD2 4.49Å; L399-L402 WeakPolarHBondContact O-CB 3.41Å; L399-L402 PolarHBondContact O-N 3.35Å; V400-L402 VanDerWaalsContact C-N 3.35Å; V400-L402 PolarHBondContact O-N 3.21Å; L402-G404 VanDerWaalsContact C-N 3.3Å; L402-G404 PolarHBondContact O-N 2.8Å; L402-K405 WeakPolarHBondContact O-CB 3.3Å; L402-K405 PolarHBondContact O-N 3.3Å; L402-K405 VanDerWaalsContact O-N 3.16Å; L402-L406 PolarHBondContact O-N 3.15Å; L402-L406 VanDerWaalsContact O-N 3.08Å
403	A	97.8	Very high	95.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.1	-40	176.3	0	0	0	0	0	111.6	I335 F356 L399 V400 K405 L406 F407	I335-A403 HydrophobicContact CD1-CB 4.17Å; I335-A403 HydrophobicContact CG2-CB 3.62Å; F356-A403 HydrophobicContact CE1-CB 3.72Å; F356-A403 HydrophobicContact CZ-CB 3.97Å; L399-A403 WeakPolarHBondContact O-CB 3.29Å; L399-A403 PolarHBondContact O-N 2.87Å; V400-A403 PolarHBondContact O-N 3.17Å; A403-K405 VanDerWaalsContact C-N 3.34Å; A403-K405 PolarHBondContact O-N 2.91Å; A403-L406 PolarHBondContact O-N 3.45Å; A403-L406 VanDerWaalsContact O-N 3.13Å; A403-F407 WeakPolarHBondContact O-CB 3.49Å; A403-F407 PolarHBondContact O-N 2.74Å
404	G	97.5	Very high	95.8	Very high	10 Å²	10	49.7 Å²	49.7	10%	0.103	27%	0.265	C	S	.	.	H	α-helix	trans	-54.2	-48.2	171.5	0	0	0	0	0	112.2	V400 L401 L402 L406 F407 H408	V400-G404 PolarHBondContact O-N 3.15Å; L401-G404 PolarHBondContact O-N 2.65Å; L402-G404 VanDerWaalsContact C-N 3.3Å; L402-G404 PolarHBondContact O-N 2.8Å; G404-L406 VanDerWaalsContact C-N 3.33Å; G404-L406 PolarHBondContact O-N 2.96Å; G404-F407 PolarHBondContact O-N 2.99Å; G404-H408 PolarHBondContact O-N 2.87Å; G404-H408 VanDerWaalsContact O-N 3.08Å; G404-H408 PolarHBondContact O-ND1 3.27Å
405	K	97.6	Very high	95.9	Very high	146 Å²	146	49.5 Å²	49.5	64%	0.635	27%	0.271	S	S	*	.	H	α-helix	trans	-62.5	-38.2	176.6	-65.6	174.4	-175.1	178.7	0	112.7	L401 L402 A403 K409	L401-K405 PolarHBondContact O-N 3.37Å; L402-K405 WeakPolarHBondContact O-CB 3.3Å; L402-K405 PolarHBondContact O-N 3.3Å; L402-K405 VanDerWaalsContact O-N 3.16Å; A403-K405 VanDerWaalsContact C-N 3.34Å; A403-K405 PolarHBondContact O-N 2.91Å; K405-K409 WeakPolarHBondContact O-CG 3.38Å
406	L	98.3	Very high	95.9	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-69.8	-38.3	176.6	-65	-179.6	0	0	0	111.8	F356 L358 R375 A377 L402 A403 G404 K409	F356-L406 HydrophobicContact CD1-CD1 3.75Å; F356-L406 HydrophobicContact CE1-CD1 3.99Å; L358-L406 HydrophobicContact CB-CB 4.24Å; L358-L406 HydrophobicContact CB-CD1 4.13Å; L358-L406 HydrophobicContact CD2-CB 4.2Å; R375-L406 HydrophobicContact CB-CB 4.24Å; R375-L406 HydrophobicContact CB-CD2 4Å; A377-L406 HydrophobicContact CB-CD1 4.49Å; A377-L406 HydrophobicContact CB-CD2 3.97Å; L402-L406 PolarHBondContact O-N 3.15Å; L402-L406 VanDerWaalsContact O-N 3.08Å; A403-L406 PolarHBondContact O-N 3.45Å; A403-L406 VanDerWaalsContact O-N 3.13Å; G404-L406 VanDerWaalsContact C-N 3.33Å; G404-L406 PolarHBondContact O-N 2.96Å; L406-K409 WeakPolarHBondContact O-CB 3.24Å; L406-K409 PolarHBondContact O-N 2.84Å
407	F	97.9	Very high	95.8	Very high	0 Å²	0	55 Å²	55	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-48	178.9	-179.1	-105.7	0	0	0	112	V328 V331 M332 L358 A403 G404 K409 M410 V411 F417 L419	V328-F407 HydrophobicContact CG1-CE1 4.41Å; V328-F407 HydrophobicContact CG2-CE1 4.26Å; V331-F407 HydrophobicContact CB-CZ 4.4Å; V331-F407 HydrophobicContact CG1-CD2 3.87Å; V331-F407 HydrophobicContact CG1-CE1 4.38Å; V331-F407 HydrophobicContact CG1-CE2 3.73Å; V331-F407 HydrophobicContact CG1-CG 4.26Å; V331-F407 HydrophobicContact CG1-CZ 4Å; V331-F407 HydrophobicContact CG2-CE2 4.28Å; V331-F407 HydrophobicContact CG2-CZ 4.07Å; M332-F407 HydrophobicContact CE-CB 3.87Å; M332-F407 HydrophobicContact CE-CD1 3.63Å; M332-F407 HydrophobicContact CE-CE1 4.44Å; M332-F407 HydrophobicContact CE-CG 3.87Å; L358-F407 HydrophobicContact CD2-CB 3.9Å; A403-F407 WeakPolarHBondContact O-CB 3.49Å; A403-F407 PolarHBondContact O-N 2.74Å; G404-F407 PolarHBondContact O-N 2.99Å; F407-K409 PolarHBondContact O-N 2.79Å; F407-K409 VanDerWaalsContact O-N 3.13Å; F407-M410 WeakPolarHBondContact O-CA 3.35Å; F407-M410 PolarHBondContact O-N 3.46Å; F407-V411 HydrophobicContact CD2-CG2 4.06Å; F407-V411 HydrophobicContact CE1-CB 4.06Å; F407-V411 HydrophobicContact CE1-CG1 4.38Å; F407-V411 HydrophobicContact CE1-CG2 4.46Å; F407-V411 HydrophobicContact CE2-CB 3.94Å; F407-V411 HydrophobicContact CE2-CG2 3.43Å; F407-V411 VanDerWaalsContact CE2-CG2 3.43Å; F407-V411 HydrophobicContact CZ-CB 3.68Å; F407-V411 HydrophobicContact CZ-CG1 3.91Å; F407-V411 HydrophobicContact CZ-CG2 3.67Å; F407-V411 PolarHBondContact O-N 2.86Å; F407-F417 HydrophobicContact CE1-CZ 4.46Å; F407-F417 HydrophobicContact CZ-CE1 4.47Å; F407-F417 HydrophobicContact CZ-CE2 4.2Å; F407-F417 AromaticContact CZ-CZ 3.99Å; F407-F417 HydrophobicContact CZ-CZ 3.99Å; F407-L419 HydrophobicContact CE2-CD1 3.76Å; F407-L419 HydrophobicContact CZ-CD1 4.27Å
408	H	96.8	Very high	95.8	Very high	111 Å²	111	54.4 Å²	54.4	51%	0.514	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-18.3	177.4	-70.2	86.1	0	0	0	113.4	G404 M410 C413	G404-H408 PolarHBondContact O-N 2.87Å; G404-H408 VanDerWaalsContact O-N 3.08Å; G404-H408 PolarHBondContact O-ND1 3.27Å; H408-M410 VanDerWaalsContact C-N 3.34Å; H408-C413 PolarHBondContact CD2-SG 3.39Å; H408-C413 PolarHBondContact NE2-SG 2.89Å
409	K	96.8	Very high	95.8	Very high	148 Å²	148	51.7 Å²	51.7	64%	0.643	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-13.2	171.6	-69.8	179.3	178.8	-171.3	0	113.6	R375 K405 L406 F407	R375-K409 HydrophobicContact CG-CB 4.44Å; K405-K409 WeakPolarHBondContact O-CG 3.38Å; L406-K409 WeakPolarHBondContact O-CB 3.24Å; L406-K409 PolarHBondContact O-N 2.84Å; F407-K409 PolarHBondContact O-N 2.79Å; F407-K409 VanDerWaalsContact O-N 3.13Å
410	M	96.4	Very high	95.7	Very high	14 Å²	14	52 Å²	52	7%	0.069	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-31.8	179.4	-64.5	-172.8	-69	0	0	112.1	L358 I360 R362 R375 F407 H408	L358-M410 HydrophobicContact CB-CE 4.28Å; L358-M410 HydrophobicContact CD2-CE 3.68Å; L358-M410 HydrophobicContact CG-CE 3.84Å; I360-M410 HydrophobicContact CD1-CB 3.9Å; I360-M410 HydrophobicContact CD1-CE 4.33Å; I360-M410 HydrophobicContact CD1-SD 4.33Å; I360-M410 HydrophobicContact CG1-CE 4.26Å; I360-M410 HydrophobicContact CG1-SD 4.15Å; I360-M410 HydrophobicContact CG2-CE 4.05Å; R362-M410 PolarHBondContact NH2-O 2.9Å; R375-M410 HydrophobicContact CB-CG 4.23Å; R375-M410 HydrophobicContact CB-SD 4.09Å; R375-M410 HydrophobicContact CG-CG 3.3Å; R375-M410 HydrophobicContact CG-SD 3.66Å; F407-M410 WeakPolarHBondContact O-CA 3.35Å; F407-M410 PolarHBondContact O-N 3.46Å; H408-M410 VanDerWaalsContact C-N 3.34Å
411	V	95.3	Very high	95.6	Very high	3 Å²	3	51 Å²	51	2%	0.018	29%	0.288	C	S	.	.			trans	-124.9	124.8	-173.6	-173.4	0	0	0	0	110.2	I360 F407 C413 F417	I360-V411 HydrophobicContact CD1-CG2 3.51Å; F407-V411 HydrophobicContact CD2-CG2 4.06Å; F407-V411 HydrophobicContact CE1-CB 4.06Å; F407-V411 HydrophobicContact CE1-CG1 4.38Å; F407-V411 HydrophobicContact CE1-CG2 4.46Å; F407-V411 HydrophobicContact CE2-CB 3.94Å; F407-V411 HydrophobicContact CE2-CG2 3.43Å; F407-V411 VanDerWaalsContact CE2-CG2 3.43Å; F407-V411 HydrophobicContact CZ-CB 3.68Å; F407-V411 HydrophobicContact CZ-CG1 3.91Å; F407-V411 HydrophobicContact CZ-CG2 3.67Å; F407-V411 PolarHBondContact O-N 2.86Å; V411-C413 PolarHBondContact O-N 2.71Å; V411-F417 HydrophobicContact CG1-CB 3.9Å; V411-F417 HydrophobicContact CG1-CD1 3.51Å; V411-F417 HydrophobicContact CG1-CD2 4.34Å; V411-F417 HydrophobicContact CG1-CE1 4.06Å; V411-F417 HydrophobicContact CG1-CG 3.66Å
412	D	93.6	Very high	95.7	Very high	95 Å²	95	45.3 Å²	45.3	51%	0.508	26%	0.258	S	S	.	.			trans	-71.9	103.6	164.7	179.8	3.8	0	0	0	108.9	S414 A415	D412-S414 VanDerWaalsContact CG-OG 3.26Å; D412-S414 PolarHBondContact O-N 2.87Å; D412-S414 WeakPolarHBondContact OD1-CB 3.39Å; D412-S414 PolarHBondContact OD1-N 3.21Å; D412-S414 PolarHBondContact OD1-OG 3.44Å; D412-S414 PolarHBondContact OD2-OG 3.43Å; D412-A415 HydrophobicContact CB-CB 4.43Å; D412-A415 PolarHBondContact O-N 3.02Å
413	C	91.9	Very high	95.7	Very high	44 Å²	44	44.6 Å²	44.6	30%	0.297	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.6	-179.5	-61.2	0	0	0	0	113.4	V328 H408 V411	V328-C413 HydrophobicContact CG2-CB 3.95Å; H408-C413 PolarHBondContact CD2-SG 3.39Å; H408-C413 PolarHBondContact NE2-SG 2.89Å; V411-C413 PolarHBondContact O-N 2.71Å
414	S	90.9	Very high	95.7	Very high	111 Å²	111	44.6 Å²	44.6	78%	0.776	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-21.5	173.7	75	0	0	0	0	112.3	D412	D412-S414 VanDerWaalsContact CG-OG 3.26Å; D412-S414 PolarHBondContact O-N 2.87Å; D412-S414 WeakPolarHBondContact OD1-CB 3.39Å; D412-S414 PolarHBondContact OD1-N 3.21Å; D412-S414 PolarHBondContact OD1-OG 3.44Å; D412-S414 PolarHBondContact OD2-OG 3.43Å
415	A	93.1	Very high	95.8	Very high	50 Å²	50	44.1 Å²	44.1	41%	0.413	25%	0.249	S	C	.	.	S	Bend	trans	-98.4	156.9	175.9	0	0	0	0	0	112	D412	D412-A415 HydrophobicContact CB-CB 4.43Å; D412-A415 PolarHBondContact O-N 3.02Å
416	A	93.8	Very high	95.8	Very high	110 Å²	110	37.1 Å²	37.1	91%	0.909	22%	0.219	S	C	*	.			trans	-65.8	137.4	170.7	0	0	0	0	0	110.6
417	F	94.6	Very high	95.7	Very high	17 Å²	17	37.5 Å²	37.5	8%	0.075	22%	0.222	C	C	.	.			trans	-136.3	158.7	175.9	62.9	-98.3	0	0	0	111.3	C326 V328 V331 F407 V411 L419	C326-F417 WeakPolarHBondContact CA-O 3.4Å; C326-F417 WeakPolarHBondContact CB-O 3.26Å; C326-F417 WeakPolarHBondContact O-CZ 3.19Å; C326-F417 PolarHBondContact SG-O 2.55Å; V328-F417 HydrophobicContact CG2-CE1 4.12Å; V328-F417 HydrophobicContact CG2-CZ 4.19Å; V331-F417 HydrophobicContact CG2-CE2 4.1Å; V331-F417 HydrophobicContact CG2-CZ 4.41Å; F407-F417 HydrophobicContact CE1-CZ 4.46Å; F407-F417 HydrophobicContact CZ-CE1 4.47Å; F407-F417 HydrophobicContact CZ-CE2 4.2Å; F407-F417 AromaticContact CZ-CZ 3.99Å; F407-F417 HydrophobicContact CZ-CZ 3.99Å; V411-F417 HydrophobicContact CG1-CB 3.9Å; V411-F417 HydrophobicContact CG1-CD1 3.51Å; V411-F417 HydrophobicContact CG1-CD2 4.34Å; V411-F417 HydrophobicContact CG1-CE1 4.06Å; V411-F417 HydrophobicContact CG1-CG 3.66Å; F417-L419 HydrophobicContact CD2-CD1 4.33Å; F417-L419 HydrophobicContact CD2-CD2 4.46Å; F417-L419 HydrophobicContact CD2-CG 3.93Å; F417-L419 HydrophobicContact CE2-CD1 4.23Å; F417-L419 HydrophobicContact CE2-CG 4.25Å
418	H	94.4	Very high	95.6	Very high	52 Å²	52	42.2 Å²	42.2	24%	0.241	25%	0.247	C	C	.	.			trans	-137	109.2	177	178.6	178.8	0	0	0	108.7	R323 K324 R362 F363	R323-H418 PolarHBondContact O-NE2 3.19Å; K324-H418 WeakPolarHBondContact CA-NE2 3.48Å; R362-H418 WeakPolarHBondContact CA-O 2.98Å; F363-H418 HydrophobicContact CB-CB 4.05Å; F363-H418 VanDerWaalsContact CB-CG 3.49Å; F363-H418 WeakPolarHBondContact CB-ND1 3.44Å; F363-H418 AromaticContact CD1-ND1 3.76Å; F363-H418 AromaticContact CD2-CE1 3.75Å; F363-H418 AromaticContact CG-CE1 3.5Å; F363-H418 VanDerWaalsContact CG-CE1 3.5Å; F363-H418 WeakPolarHBondContact CG-CE1 3.31Å; F363-H418 AromaticContact CG-ND1 3.54Å; F363-H418 PolarHBondContact N-O 3.24Å
419	L	95.4	Very high	95.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	153.3	174.8	-53.5	-179.3	0	0	0	111.3	F322 M325 V331 I360 R361 R362 F407 F417	F322-L419 WeakPolarHBondContact CD2-O 3.06Å; F322-L419 VanDerWaalsContact CE2-C 3.43Å; F322-L419 HydrophobicContact CE2-CB 3.9Å; F322-L419 WeakPolarHBondContact CE2-O 3.3Å; F322-L419 HydrophobicContact CZ-CB 4.21Å; M325-L419 HydrophobicContact CB-CB 4.48Å; M325-L419 PolarHBondContact N-O 3.08Å; M325-L419 PolarHBondContact O-N 3.01Å; V331-L419 HydrophobicContact CG2-CD1 3.86Å; I360-L419 HydrophobicContact CB-CD2 4.43Å; I360-L419 HydrophobicContact CD1-CD2 4.03Å; I360-L419 HydrophobicContact CG2-CD1 4.39Å; R361-L419 CarbonylContact O-C 3.56Å; R361-L419 VanDerWaalsContact O-CA 3.32Å; R361-L419 WeakPolarHBondContact O-CA 3.48Å; R362-L419 HydrophobicContact CG-CD2 3.86Å; F407-L419 HydrophobicContact CE2-CD1 3.76Å; F407-L419 HydrophobicContact CZ-CD1 4.27Å; F417-L419 HydrophobicContact CD2-CD1 4.33Å; F417-L419 HydrophobicContact CD2-CD2 4.46Å; F417-L419 HydrophobicContact CD2-CG 3.93Å; F417-L419 HydrophobicContact CE2-CD1 4.23Å; F417-L419 HydrophobicContact CE2-CG 4.25Å
420	T	95.3	Very high	95.2	Very high	9 Å²	9	36.3 Å²	36.3	6%	0.055	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	-5	177.5	62.2	0	0	0	0	113.7	S321 F322 R361 F363	S321-T420 WeakPolarHBondContact CA-O 3.36Å; F322-T420 PolarHBondContact N-O 3.36Å; F322-T420 VanDerWaalsContact O-CA 3.3Å; F322-T420 WeakPolarHBondContact O-CA 3.46Å; R361-T420 WeakPolarHBondContact CG-OG1 3.41Å; R361-T420 PolarHBondContact NE-OG1 3.06Å; R361-T420 PolarHBondContact O-N 3.49Å; R361-T420 PolarHBondContact O-OG1 2.89Å; F363-T420 HydrophobicContact CB-CG2 3.88Å; F363-T420 HydrophobicContact CD2-CG2 4.2Å
421	L	96.4	Very high	94.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	143.7	175.7	178.2	152.2	0	0	0	110.7	D320 I360 R361 N423	D320-L421 VanDerWaalsContact O-CA 3.31Å; D320-L421 WeakPolarHBondContact O-CA 3.25Å; I360-L421 WeakPolarHBondContact CA-O 3.42Å; R361-L421 HydrophobicContact CB-CB 3.73Å; R361-L421 PolarHBondContact N-O 3.42Å; L421-N423 HydrophobicContact CD2-CB 4.06Å
422	I	97.9	Very high	93.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.5	163.5	-69.6	162.1	0	0	0	108.4	E319 D320 F322 M325 V331 K334 I335 L338 L358 T359 I360	E319-I422 VanDerWaalsContact CA-O 3.31Å; E319-I422 WeakPolarHBondContact CA-O 3.36Å; D320-I422 PolarHBondContact N-O 2.83Å; D320-I422 PolarHBondContact O-N 2.7Å; F322-I422 HydrophobicContact CE1-CB 4.29Å; F322-I422 HydrophobicContact CE1-CD1 4.04Å; F322-I422 HydrophobicContact CE1-CG1 4.08Å; F322-I422 HydrophobicContact CZ-CD1 3.83Å; F322-I422 HydrophobicContact CZ-CG1 3.85Å; M325-I422 HydrophobicContact SD-CD1 3.69Å; V331-I422 HydrophobicContact CB-CD1 4.35Å; V331-I422 HydrophobicContact CG1-CD1 3.96Å; V331-I422 HydrophobicContact CG2-CD1 4.33Å; K334-I422 HydrophobicContact CB-CD1 4.2Å; K334-I422 HydrophobicContact CG-CD1 4.11Å; I335-I422 HydrophobicContact CG1-CG2 3.84Å; L338-I422 HydrophobicContact CD1-CB 4.35Å; L338-I422 HydrophobicContact CD1-CG2 3.83Å; L358-I422 HydrophobicContact CD1-CG2 4.03Å; T359-I422 CarbonylContact O-C 3.49Å; T359-I422 WeakPolarHBondContact O-CA 3.18Å; I360-I422 HydrophobicContact CG2-CG1 4.44Å
423	N	98.1	Very high	91.7	Very high	12 Å²	12	47.9 Å²	47.9	6%	0.064	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.4	171.4	163.7	-86.3	0	0	0	110	D318 E319 T359 L421	D318-N423 WeakPolarHBondContact O-CA 3.15Å; D318-N423 PolarHBondContact O-ND2 3.17Å; E319-N423 HydrophobicContact CB-CB 3.74Å; T359-N423 PolarHBondContact N-O 2.95Å; T359-N423 PolarHBondContact O-N 3.34Å; L421-N423 HydrophobicContact CD2-CB 4.06Å
424	V	98.4	Very high	89.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.2	172.4	-69.2	0	0	0	0	109	S317 D318 I335 L338 L339 L342 F356 L358	S317-V424 CarbonylContact C-O 3.55Å; S317-V424 WeakPolarHBondContact CA-O 3.24Å; S317-V424 WeakPolarHBondContact CB-O 3.41Å; D318-V424 PolarHBondContact N-O 2.8Å; D318-V424 PolarHBondContact O-N 3.21Å; I335-V424 HydrophobicContact CG2-CG1 4.25Å; L338-V424 HydrophobicContact CB-CG2 3.53Å; L338-V424 HydrophobicContact CD1-CG2 4.37Å; L339-V424 HydrophobicContact CD2-CB 4.42Å; L339-V424 HydrophobicContact CD2-CG2 4.45Å; L342-V424 HydrophobicContact CD2-CB 4.21Å; L342-V424 HydrophobicContact CD2-CG2 3.79Å; F356-V424 HydrophobicContact CE2-CB 3.98Å; F356-V424 HydrophobicContact CE2-CG1 4.19Å; F356-V424 HydrophobicContact CZ-CB 4.27Å; F356-V424 HydrophobicContact CZ-CG1 3.96Å; L358-V424 HydrophobicContact CD1-CG1 3.97Å
425	C	98.4	Very high	86.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	134.3	-174.1	178.2	0	0	0	0	112.3	L316 F356 R357	L316-C425 CarbonylContact O-C 3.46Å; L316-C425 WeakPolarHBondContact O-CA 3.14Å; L316-C425 PolarHBondContact O-SG 2.84Å; F356-C425 CarbonylContact C-O 3.59Å; F356-C425 WeakPolarHBondContact CA-O 3.42Å; R357-C425 HydrophobicContact CB-CB 4.27Å; R357-C425 PolarHBondContact N-O 3.42Å; R357-C425 PolarHBondContact NH2-SG 3.01Å; R357-C425 PolarHBondContact O-N 3.49Å
426	F	98	Very high	84.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133	162.9	-66.5	-37.6	0	0	0	110.6	S315 L316 L339 L342 V343 M346 P353 T355 F356 I379 I387 L399 L429	S315-F426 CarbonylContact C-O 3.52Å; S315-F426 WeakPolarHBondContact CA-O 3.49Å; S315-F426 VanDerWaalsContact CB-O 3.23Å; S315-F426 WeakPolarHBondContact CB-O 3.32Å; L316-F426 PolarHBondContact N-O 3.43Å; L316-F426 PolarHBondContact O-N 2.95Å; L339-F426 HydrophobicContact CD2-CZ 4.47Å; L342-F426 HydrophobicContact CD1-CD2 3.91Å; L342-F426 HydrophobicContact CD1-CE2 4.36Å; L342-F426 HydrophobicContact CD2-CD2 3.83Å; L342-F426 HydrophobicContact CD2-CE2 3.9Å; L342-F426 HydrophobicContact CD2-CG 4.2Å; L342-F426 HydrophobicContact CD2-CZ 4.32Å; L342-F426 HydrophobicContact CG-CD2 3.61Å; L342-F426 HydrophobicContact CG-CE2 3.6Å; L342-F426 HydrophobicContact CG-CG 4.44Å; L342-F426 HydrophobicContact CG-CZ 4.41Å; V343-F426 HydrophobicContact CG2-CE2 4.24Å; V343-F426 HydrophobicContact CG2-CZ 4.14Å; M346-F426 HydrophobicContact CB-CD2 3.87Å; M346-F426 HydrophobicContact CB-CE2 3.97Å; M346-F426 HydrophobicContact CG-CD2 3.78Å; M346-F426 HydrophobicContact CG-CE2 4.14Å; M346-F426 HydrophobicContact SD-CB 4.25Å; M346-F426 HydrophobicContact SD-CD2 4.02Å; P353-F426 HydrophobicContact CB-CB 3.7Å; P353-F426 HydrophobicContact CB-CD1 4.08Å; P353-F426 HydrophobicContact CB-CD2 4.45Å; P353-F426 HydrophobicContact CB-CG 3.84Å; P353-F426 HydrophobicContact CG-CB 4.47Å; P353-F426 HydrophobicContact CG-CD1 4.24Å; P353-F426 HydrophobicContact CG-CD2 4.34Å; P353-F426 HydrophobicContact CG-CG 4.11Å; T355-F426 WeakPolarHBondContact O-CA 3.47Å; F356-F426 AromaticContact CD2-CD1 3.87Å; F356-F426 HydrophobicContact CD2-CD1 3.87Å; F356-F426 AromaticContact CD2-CE1 3.62Å; F356-F426 HydrophobicContact CD2-CE1 3.62Å; F356-F426 HydrophobicContact CE2-CE1 4.3Å; F356-F426 HydrophobicContact CG-CE1 4.5Å; I379-F426 HydrophobicContact CD1-CD1 3.66Å; I379-F426 HydrophobicContact CD1-CE1 3.82Å; I387-F426 HydrophobicContact CD1-CE1 4.36Å; I387-F426 HydrophobicContact CD1-CE2 4.38Å; I387-F426 HydrophobicContact CD1-CZ 3.97Å; L399-F426 HydrophobicContact CD1-CE1 4.03Å; L399-F426 HydrophobicContact CD1-CZ 3.61Å; L399-F426 HydrophobicContact CD2-CE1 4.24Å; F426-L429 HydrophobicContact CB-CD2 4.2Å
427	S	96.9	Very high	81.7	Confident	11 Å²	11	53.4 Å²	53.4	8%	0.077	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	175.7	178.3	56.4	0	0	0	0	110.9	Q354 T355	Q354-S427 PolarHBondContact N-O 3.5Å; T355-S427 PolarHBondContact N-O 2.83Å; T355-S427 VanDerWaalsContact N-O 3.13Å; T355-S427 PolarHBondContact O-N 2.94Å
428	N	94.9	Very high	78.8	Confident	99 Å²	99	55.1 Å²	55.1	53%	0.529	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.2	53.4	-173.7	-63.7	-29.2	0	0	0	111	Q354 T355	Q354-N428 HydrophobicContact CB-CB 3.95Å; Q354-N428 WeakPolarHBondContact CB-O 3.43Å; Q354-N428 WeakPolarHBondContact CG-O 3.34Å; Q354-N428 PolarHBondContact N-O 3.23Å; T355-N428 PolarHBondContact OG1-ND2 3.35Å
429	L	94.6	Very high	76.5	Confident	26 Å²	26	63.2 Å²	63.2	14%	0.136	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	127.9	-175.4	-48.8	179.7	0	0	0	110.1	P313 L316 M346 R351 P353 F426	P313-L429 WeakPolarHBondContact O-CD1 3.37Å; L316-L429 HydrophobicContact CD1-CD1 3.45Å; L316-L429 VanDerWaalsContact CD1-CD1 3.45Å; M346-L429 HydrophobicContact CE-CD1 4.35Å; M346-L429 HydrophobicContact CE-CD2 3.98Å; M346-L429 HydrophobicContact SD-CD2 3.78Å; R351-L429 HydrophobicContact CB-CB 4.32Å; P353-L429 HydrophobicContact CB-CD2 3.7Å; F426-L429 HydrophobicContact CB-CD2 4.2Å
430	Q	91.2	Very high	74.3	Confident	109 Å²	109	66.9 Å²	66.9	51%	0.509	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.2	-177.7	-67.4	-178.1	-6.1	0	0	111.1	R351 Q352 Q354	R351-Q430 WeakPolarHBondContact CA-O 3.39Å; R351-Q430 WeakPolarHBondContact CB-O 3.49Å; Q352-Q430 PolarHBondContact N-O 2.99Å; Q352-Q430 PolarHBondContact O-N 3.14Å; Q354-Q430 HydrophobicContact CG-CG 3.84Å
431	S	85.3	Confident	71.7	Confident	99 Å²	99	68.8 Å²	68.8	69%	0.692	44%	0.437	S	S	*	.			trans	-64.5	141.7	169.4	-56.4	0	0	0	0	109.9	G433	S431-G433 PolarHBondContact O-N 2.94Å
432	R	70.8	Confident	69.2	Low	209 Å²	209	74.4 Å²	74.4	79%	0.789	47%	0.466	S	S	*	.			trans	-62.3	105.6	174.4	-176.2	177.9	178.6	-169.6	0.4	109
433	G	55.5	Low	66.1	Low	47 Å²	47	78.8 Å²	78.8	49%	0.485	49%	0.492	S	S	.	.			trans	-62.7	144.8	161.9	0	0	0	0	0	109	S431 A435	S431-G433 PolarHBondContact O-N 2.94Å; G433-A435 PolarHBondContact O-N 3.41Å
434	P	40.9	Very low	63.5	Low	125 Å²	125	82.1 Å²	82.1	81%	0.812	52%	0.517	S	S	*	.			trans	-52.3	131.7	165.8	23.2	-30.6	0	0	0	107.1	A436	P434-A436 PolarHBondContact O-N 2.86Å
435	A	40.7	Very low	60.5	Low	92 Å²	92	90.7 Å²	90.7	76%	0.76	56%	0.555	S	S	*	*			trans	-50.3	106.2	-177	0	0	0	0	0	108.7	G433 S437	G433-A435 PolarHBondContact O-N 3.41Å; A435-S437 PolarHBondContact O-N 2.77Å
436	A	38.3	Very low	57.4	Low	85 Å²	85	98.1 Å²	98.1	70%	0.702	59%	0.587	S	S	*	*			trans	-69.1	88.5	173.5	0	0	0	0	0	106.6	P434 G438	P434-A436 PolarHBondContact O-N 2.86Å; A436-G438 PolarHBondContact O-N 2.76Å
437	S	38.8	Very low	54.4	Low	129 Å²	129	102.7 Å²	102.7	90%	0.902	62%	0.615	S	S	*	*			trans	-61.7	94.5	158.2	173.4	0	0	0	0	106.7	A435	A435-S437 PolarHBondContact O-N 2.77Å
438	G	35.8	Very low	51.3	Low	54 Å²	54	110.6 Å²	110.6	56%	0.557	65%	0.651	S	S	*	*	S	Bend	trans	158.8	115.5	176.9	0	0	0	0	0	112.3	A436 G440	A436-G438 PolarHBondContact O-N 2.76Å; G438-G440 PolarHBondContact O-N 3.42Å
439	K	45.8	Very low	48.3	Very low	222 Å²	222	113.2 Å²	113.2	97%	0.965	67%	0.665	S	S	*	*	S	Bend	trans	-47.6	128.6	167.3	-70.8	173.5	174.4	175.6	0	110.3
440	G	48	Very low	45.2	Very low	77 Å²	77	116.7 Å²	116.7	79%	0.794	70%	0.697	S	S	*	*			trans	90.5	99.8	165.1	0	0	0	0	0	114.3	G438	G438-G440 PolarHBondContact O-N 3.42Å
441	A	41.1	Very low	42.2	Very low	48 Å²	48	115.8 Å²	115.8	40%	0.397	70%	0.703	S	S	.	*			trans	-141.6	71.3	171.5	0	0	0	0	0	110.6	T443 S444	A441-T443 VanDerWaalsContact CA-OG1 3.23Å; A441-T443 WeakPolarHBondContact CA-OG1 3.32Å; A441-T443 WeakPolarHBondContact CB-OG1 3.37Å; A441-T443 PolarHBondContact O-N 2.94Å; A441-S444 PolarHBondContact O-N 2.93Å; A441-S444 PolarHBondContact O-OG 2.86Å
442	I	43.5	Very low	39.6	Very low	118 Å²	118	117 Å²	117	61%	0.605	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.7	-12.7	152.8	-94	171.6	0	0	0	111.3	S444 F445 F446	I442-S444 PolarHBondContact O-N 3.28Å; I442-F445 WeakPolarHBondContact O-CA 3.5Å; I442-F445 WeakPolarHBondContact O-CB 3.33Å; I442-F445 PolarHBondContact O-N 2.9Å; I442-F446 HydrophobicContact CB-CE2 4.47Å; I442-F446 HydrophobicContact CG2-CD2 3.26Å; I442-F446 HydrophobicContact CG2-CE2 2.96Å; I442-F446 HydrophobicContact CG2-CG 4.44Å; I442-F446 HydrophobicContact CG2-CZ 3.94Å; I442-F446 WeakPolarHBondContact O-CD2 3.5Å; I442-F446 PolarHBondContact O-N 3.15Å; I442-F446 VanDerWaalsContact O-N 3.09Å
443	T	34.2	Very low	37.5	Very low	92 Å²	92	117.6 Å²	117.6	56%	0.564	71%	0.71	S	S	*	*	H	α-helix	trans	-53.7	-27.3	166.3	7.7	0	0	0	0	114.7	A441 F445 F446 T447	A441-T443 VanDerWaalsContact CA-OG1 3.23Å; A441-T443 WeakPolarHBondContact CA-OG1 3.32Å; A441-T443 WeakPolarHBondContact CB-OG1 3.37Å; A441-T443 PolarHBondContact O-N 2.94Å; T443-F445 VanDerWaalsContact C-N 3.33Å; T443-F446 PolarHBondContact O-N 3.33Å; T443-T447 PolarHBondContact O-N 2.98Å; T443-T447 PolarHBondContact O-OG1 3.31Å
444	S	42.3	Very low	36.6	Very low	83 Å²	83	125.4 Å²	125.4	58%	0.58	73%	0.731	S	S	*	*	H	α-helix	trans	-72.5	-24.7	171	59.2	0	0	0	0	113.4	A441 I442 T447	A441-S444 PolarHBondContact O-N 2.93Å; A441-S444 PolarHBondContact O-OG 2.86Å; I442-S444 PolarHBondContact O-N 3.28Å; S444-T447 WeakPolarHBondContact CA-OG1 3.4Å; S444-T447 PolarHBondContact O-OG1 3.32Å
445	F	35.5	Very low	35.8	Very low	180 Å²	180	125.9 Å²	125.9	79%	0.789	73%	0.732	S	S	*	*	H	α-helix	trans	-84.4	-25.5	172.8	-85.7	-92.9	0	0	0	112.6	I442 T443	I442-F445 WeakPolarHBondContact O-CA 3.5Å; I442-F445 WeakPolarHBondContact O-CB 3.33Å; I442-F445 PolarHBondContact O-N 2.9Å; T443-F445 VanDerWaalsContact C-N 3.33Å
446	F	34.3	Very low	35.1	Very low	156 Å²	156	130.4 Å²	130.4	68%	0.684	74%	0.737	S	S	*	*	H	α-helix	trans	-95.5	-6.6	177.1	-67.4	-54.3	0	0	0	114.6	I442 T443 H448	I442-F446 HydrophobicContact CB-CE2 4.47Å; I442-F446 HydrophobicContact CG2-CD2 3.26Å; I442-F446 HydrophobicContact CG2-CE2 2.96Å; I442-F446 HydrophobicContact CG2-CG 4.44Å; I442-F446 HydrophobicContact CG2-CZ 3.94Å; I442-F446 WeakPolarHBondContact O-CD2 3.5Å; I442-F446 PolarHBondContact O-N 3.15Å; I442-F446 VanDerWaalsContact O-N 3.09Å; T443-F446 PolarHBondContact O-N 3.33Å; F446-H448 PolarHBondContact O-N 3.49Å
447	T	34.4	Very low	34.5	Very low	96 Å²	96	134.4 Å²	134.4	59%	0.589	75%	0.745	S	S	*	*			trans	-74.2	87.2	166.7	26	0	0	0	0	107.5	T443 S444 N449	T443-T447 PolarHBondContact O-N 2.98Å; T443-T447 PolarHBondContact O-OG1 3.31Å; S444-T447 WeakPolarHBondContact CA-OG1 3.4Å; S444-T447 PolarHBondContact O-OG1 3.32Å; T447-N449 VanDerWaalsContact C-N 3.34Å; T447-N449 PolarHBondContact O-N 3.34Å
448	H	31.4	Very low	33.8	Very low	177 Å²	177	133.5 Å²	133.5	82%	0.819	74%	0.739	S	S	*	*			trans	-55.1	104.8	159.6	-79.8	-67.1	0	0	0	107.3	F446 A450	F446-H448 PolarHBondContact O-N 3.49Å; H448-A450 PolarHBondContact O-N 2.94Å
449	N	32.5	Very low	33.3	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	75%	0.747	S	S	*	*			trans	-47.7	118.7	151	-83.3	-12.3	0	0	0	105.3	T447 S451	T447-N449 VanDerWaalsContact C-N 3.34Å; T447-N449 PolarHBondContact O-N 3.34Å; N449-S451 PolarHBondContact O-N 2.82Å
450	A	29.7	Very low	32.2	Very low	98 Å²	98	133.2 Å²	133.2	81%	0.81	74%	0.742	S	S	*	*			trans	-60.6	90.9	172.2	0	0	0	0	0	107.5	H448	H448-A450 PolarHBondContact O-N 2.94Å
451	S	27.8	Very low	31.1	Very low	91 Å²	91	137.5 Å²	137.5	64%	0.636	74%	0.741	S	S	*	*			trans	-56	132.9	148.5	178.8	0	0	0	0	105.7	N449 R453	N449-S451 PolarHBondContact O-N 2.82Å; S451-R453 VanDerWaalsContact C-N 3.26Å; S451-R453 PolarHBondContact O-N 3.18Å
452	P	30.9	Very low	30.3	Very low	125 Å²	125	143.2 Å²	143.2	81%	0.812	77%	0.765	S	S	*	*			trans	-69.5	87.8	-173.7	27.8	-32.2	0	0	0	109
453	R	26.6	Very low	29.5	Very low	220 Å²	220	144.7 Å²	144.7	83%	0.83	77%	0.769	S	S	*	*			trans	-91.2	115.1	164.4	-79.8	-170.5	-175.2	-165.2	1.5	107.8	S451 T455	S451-R453 VanDerWaalsContact C-N 3.26Å; S451-R453 PolarHBondContact O-N 3.18Å; R453-T455 PolarHBondContact O-N 3.13Å
454	K	35.4	Very low	29.1	Very low	211 Å²	211	146.7 Å²	146.7	92%	0.917	78%	0.776	S	S	*	*			trans	-10.2	104.6	160.3	-69.6	177.6	174.2	-177.9	0	113.2
455	T	25.4	Very low	28.3	Very low	135 Å²	135	150.1 Å²	150.1	83%	0.828	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-93	116	165.9	-26	0	0	0	0	108	R453	R453-T455 PolarHBondContact O-N 3.13Å
456	Q	26.2	Very low	28.4	Very low	187 Å²	187	147.1 Å²	147.1	87%	0.874	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.6	138.3	164.6	-73.3	-165.3	-31.3	0	0	109.4	S458	Q456-S458 PolarHBondContact O-N 2.84Å
457	I	25.7	Very low	27.9	Very low	169 Å²	169	144.6 Å²	144.6	87%	0.867	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.8	122.1	176.8	-62	169.8	0	0	0	108.1
458	S	23.7	Very low	27.5	Very low	110 Å²	110	148.4 Å²	148.4	77%	0.769	81%	0.806	S	S	*	*			trans	-121.9	121.8	155.1	45.6	0	0	0	0	109.3	Q456	Q456-S458 PolarHBondContact O-N 2.84Å
459	S	24	Very low	27.2	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	81%	0.809	S	S	*	*			trans	-59.5	131.5	179.7	48.1	0	0	0	0	113.1
460	I	24.1	Very low	26.8	Very low	166 Å²	166	144.6 Å²	144.6	85%	0.851	80%	0.804	S	S	*	*			trans	-130.4	114.9	154.2	-62.7	-179	0	0	0	108.2
461	Q	24.4	Very low	26.5	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	81%	0.808	S	S	*	*			trans	-66.3	138.5	168.7	-66.1	168.1	-32.4	0	0	109.4
462	N	24.8	Very low	26.3	Very low	167 Å²	167	148.8 Å²	148.8	89%	0.893	81%	0.814	S	S	*	*			trans	-152.1	139.4	140.6	-120.6	-9.8	0	0	0	112.1
463	Q	25.7	Very low	25.9	Very low	149 Å²	149	149.3 Å²	149.3	70%	0.696	82%	0.819	S	S	*	*			trans	-96.9	155.2	-162.9	-61.8	176.2	-4.9	0	0	112.5
464	N	25.6	Very low	25.7	Very low	134 Å²	134	146.2 Å²	146.2	72%	0.717	82%	0.818	S	S	*	*			trans	82.5	99.8	143	-63.4	-16.9	0	0	0	122.3
465	N	26.4	Very low	25.2	Very low	155 Å²	155	143.1 Å²	143.1	83%	0.829	81%	0.811	S	S	*	*				74	157.1	107.3	-93.1	7.2	0	0	0	123.1
466	P	36.8	Very low	25	Very low	117 Å²	117	142.5 Å²	142.5	76%	0.76	80%	0.803	S	S	*	*				-124.8	173.9	-126.3	42.7	-28.5	0	0	0	115.1
467	A	24.7	Very low	25	Very low	104 Å²	104	140.6 Å²	140.6	86%	0.86	79%	0.793	S	S	*	*			trans	-156.7	153	159.1	0	0	0	0	0	113.1
468	Q	25.7	Very low	24.9	Very low	176 Å²	176	142 Å²	142	82%	0.822	80%	0.797	S	S	*	*			trans	-71	156.4	-169.4	-62.7	158.2	-35	0	0	114.1
469	N	24.9	Very low	24.8	Very low	163 Å²	163	143.5 Å²	143.5	87%	0.872	79%	0.794	S	S	*	*				-174.5	134.8	116	-92.6	-21.4	0	0	0	111.9
470	A	24	Very low	24.8	Very low	87 Å²	87	144.2 Å²	144.2	72%	0.719	80%	0.799	S	S	*	*			trans	-82.5	149.1	163.9	0	0	0	0	0	109.1
471	D	24	Very low	24.7	Very low	168 Å²	168	144.4 Å²	144.4	90%	0.898	80%	0.797	S	S	*	*			trans	-160.8	132.5	140.3	-101.7	-25.9	0	0	0	111.3
472	S	23.3	Very low	24.6	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	80%	0.804	S	S	*	*			trans	-87	145.9	173.2	53.8	0	0	0	0	111
473	C	23.3	Very low	24.5	Very low	136 Å²	136	143.3 Å²	143.3	92%	0.919	79%	0.793	S	S	*	*			trans	-150.7	137.1	147.8	-152.9	0	0	0	0	111.8
474	L	21.7	Very low	24.3	Very low	154 Å²	154	146.8 Å²	146.8	81%	0.806	80%	0.8	S	S	*	*			trans	-100.7	176.8	-176.9	-86.2	159.9	0	0	0	111.1
475	L	24.1	Very low	24.1	Very low	147 Å²	147	148.5 Å²	148.5	77%	0.77	81%	0.809	S	S	*	*			trans	85.1	138.5	168.7	-75.4	101.3	0	0	0	116.6
476	D	22.6	Very low	24	Very low	122 Å²	122	147.3 Å²	147.3	65%	0.652	81%	0.807	S	S	*	*			cis	-164.7	162.3	-7.6	-128.9	-6.4	0	0	0	111.2
477	H	24.5	Very low	24	Very low	146 Å²	146	147 Å²	147	68%	0.676	81%	0.806	S	S	*	*			trans	-7.9	142.5	164.3	-70.6	-69.1	0	0	0	123.2
478	Q	23.7	Very low	24.4	Very low	200 Å²	200	147.4 Å²	147.4	94%	0.935	80%	0.799	S	S	*	*				-164.8	129.1	105.9	-103.7	175.1	21.1	0	0	114.2
479	I	23	Very low	24.3	Very low	141 Å²	141	149.2 Å²	149.2	72%	0.723	80%	0.804	S	S	*	*			trans	-97.4	141.6	173.3	-69.4	166.8	0	0	0	107.4	E481	I479-E481 HydrophobicContact CG2-CG 4.42Å
480	S	23.1	Very low	24.2	Very low	119 Å²	119	145.5 Å²	145.5	83%	0.832	80%	0.804	S	S	*	*			trans	-127.5	116.4	155.2	73.4	0	0	0	0	110.8
481	E	22.1	Very low	24.1	Very low	171 Å²	171	150.5 Å²	150.5	80%	0.799	81%	0.813	S	S	*	*			trans	-83.1	147	161.8	-70.9	179.4	134	0	0	109.2	I479	I479-E481 HydrophobicContact CG2-CG 4.42Å
482	F	22.5	Very low	24	Very low	216 Å²	216	150.1 Å²	150.1	95%	0.947	81%	0.808	S	S	*	*			trans	-140.6	123.1	149.6	-110.9	-83.6	0	0	0	109.8
483	S	21.9	Very low	23.9	Very low	94 Å²	94	150.5 Å²	150.5	66%	0.657	81%	0.805	S	S	*	*			trans	-109.7	133.9	-180	-159.9	0	0	0	0	110.1
484	R	23.2	Very low	23.7	Very low	223 Å²	223	149.3 Å²	149.3	84%	0.842	80%	0.797	S	S	*	*			trans	39.2	135.9	146.3	-62.6	177.8	-175.7	168.5	2.8	121.3
485	N	21.3	Very low	23.7	Very low	169 Å²	169	149.6 Å²	149.6	90%	0.904	80%	0.799	S	S	*	*				-160.1	153.3	125.5	-93.3	-27.9	0	0	0	113.2
486	V	24.5	Very low	23.6	Very low	130 Å²	130	147.4 Å²	147.4	79%	0.788	80%	0.797	S	S	*	*			trans	-142.3	168.8	-169.2	166.6	0	0	0	0	105.1
487	P	36.5	Very low	23.7	Very low	112 Å²	112	150.7 Å²	150.7	73%	0.727	81%	0.808	S	S	*	*			cis	-126.3	-141.6	-27	40	-18	0	0	0	110.7
488	P	32.3	Very low	23.5	Very low	112 Å²	112	152.5 Å²	152.5	73%	0.727	82%	0.817	S	S	*	*			cis	-139.8	154.6	39.4	33	-7.9	0	0	0	120
489	K	23.8	Very low	23.6	Very low	214 Å²	214	148.9 Å²	148.9	93%	0.93	81%	0.814	S	S	*	*			trans	25	136.8	141.6	-65.9	-179.7	175.7	179.8	0	123.6
490	G	22.6	Very low	23.6	Very low	84 Å²	84	149.9 Å²	149.9	87%	0.866	82%	0.815	S	S	*	*			trans	-157	143.7	151.5	0	0	0	0	0	110.6
491	Q	21.7	Very low	23.6	Very low	193 Å²	193	153.7 Å²	153.7	90%	0.902	82%	0.82	S	S	*	*			trans	-114.7	177.5	-156.7	-169.2	179.1	10.9	0	0	111.9
492	M	21.8	Very low	23.7	Very low	160 Å²	160	151.3 Å²	151.3	79%	0.788	81%	0.813	S	S	*	*			trans	102.9	104.1	164.4	-73.9	177.5	76.4	0	0	116.2
493	T	21.1	Very low	23.7	Very low	118 Å²	118	151.2 Å²	151.2	72%	0.724	81%	0.808	S	S	*	*				97.9	139.5	74	50.9	0	0	0	0	113.1
494	C	20.3	Very low	23.8	Very low	110 Å²	110	155.2 Å²	155.2	74%	0.743	82%	0.816	S	S	*	*			trans	-55.4	152.3	179.9	42.9	0	0	0	0	116.1
495	N	21.1	Very low	23.8	Very low	160 Å²	160	149.6 Å²	149.6	86%	0.856	82%	0.817	S	S	*	*				-165	147.3	125.3	-95.5	-8.5	0	0	0	112.9
496	S	22.9	Very low	23.9	Very low	102 Å²	102	146.9 Å²	146.9	71%	0.713	81%	0.812	S	S	*	*			trans	-93.4	140.5	179.7	46.4	0	0	0	0	112
497	E	23.1	Very low	23.8	Very low	191 Å²	191	146.4 Å²	146.4	89%	0.893	81%	0.813	S	S	*	*			trans	-150.7	105	154.5	-66.3	-173.1	156.5	0	0	106.1
498	Q	21.9	Very low	23.3	Very low	183 Å²	183	146.5 Å²	146.5	86%	0.855	82%	0.816	S	S	*	*				49.6	110.1	87.6	-76.6	-170.3	-16.8	0	0	115.1
499	S	24	Very low	23.1	Very low	124 Å²	124	147.6 Å²	147.6	87%	0.867	82%	0.821	S	S	*	*			trans	-154.9	112.5	133.7	25.2	0	0	0	0	108.6
500	E	23.9	Very low	23.2	Very low	162 Å²	162	146.6 Å²	146.6	76%	0.757	82%	0.819	S	S	*	*			trans	-71.2	150	163.9	-62.2	173	152	0	0	109.1
501	E	24.1	Very low	23.4	Very low	199 Å²	199	146.2 Å²	146.2	93%	0.93	82%	0.815	S	S	*	*				-159.1	131.4	127.7	-110.9	174.4	-161.7	0	0	111
502	N	22.6	Very low	24	Very low	122 Å²	122	145.1 Å²	145.1	65%	0.652	81%	0.814	S	S	*	*			trans	-77.5	156.7	-175.8	-68.9	-53.8	0	0	0	112
503	Y	23.9	Very low	24.2	Very low	214 Å²	214	145.1 Å²	145.1	84%	0.839	82%	0.817	S	S	*	*				175.3	138.9	98.8	-101.6	-80.3	0	0	0	112.2
504	E	23.3	Very low	25	Very low	177 Å²	177	144.6 Å²	144.6	83%	0.827	82%	0.818	S	S	*	*			trans	-61	156.3	174.1	-59.1	165.4	130.5	0	0	113.5
505	A	23.7	Very low	25.6	Very low	105 Å²	105	146.6 Å²	146.6	87%	0.868	82%	0.822	S	S	*	*				-161.4	133.1	129.9	0	0	0	0	0	111.8
506	S	23.9	Very low	26.7	Very low	113 Å²	113	147.1 Å²	147.1	79%	0.79	82%	0.816	S	S	*	*			trans	-84.5	150.2	-176.3	47	0	0	0	0	114.9
507	C	22.3	Very low	27.9	Very low	120 Å²	120	146.3 Å²	146.3	81%	0.811	81%	0.807	S	S	*	*			trans	39.2	121.3	134.6	-160.9	0	0	0	0	120.6
508	S	24.6	Very low	29.4	Very low	113 Å²	113	146.2 Å²	146.2	79%	0.79	80%	0.804	S	S	*	*				-174.6	134	122.4	46.2	0	0	0	0	113.1
509	T	29.3	Very low	31.3	Very low	136 Å²	136	139 Å²	139	83%	0.834	77%	0.773	S	S	*	*			trans	-75.4	128.6	166.5	42.8	0	0	0	0	112.1
510	E	25.8	Very low	33.2	Very low	193 Å²	193	133.6 Å²	133.6	90%	0.902	74%	0.735	S	S	*	*			trans	-138.7	126.1	151.8	-68.7	-166.7	164.1	0	0	105.4
511	G	26	Very low	34.5	Very low	76 Å²	76	131.5 Å²	131.5	78%	0.784	74%	0.735	S	S	*	*				105.4	97.7	66.3	0	0	0	0	0	107.8	N513	G511-N513 PolarHBondContact O-N 3.04Å
512	I	33.6	Very low	36.1	Very low	170 Å²	170	127.7 Å²	127.7	87%	0.872	72%	0.717	S	S	*	*			trans	-51.4	128	-177.9	-64.3	164.3	0	0	0	111
513	N	27.6	Very low	37.8	Very low	160 Å²	160	123.4 Å²	123.4	86%	0.856	70%	0.695	S	S	*	*			trans	-131.2	116.5	159.6	-136.4	-10.7	0	0	0	110.2	G511 D515	G511-N513 PolarHBondContact O-N 3.04Å; N513-D515 PolarHBondContact O-N 2.85Å
514	S	37.2	Very low	39.9	Very low	107 Å²	107	117.5 Å²	117.5	75%	0.748	68%	0.678	S	S	*	*			trans	-81.3	97.6	-177.4	54.1	0	0	0	0	110.4
515	D	33.8	Very low	41.7	Very low	152 Å²	152	112.3 Å²	112.3	81%	0.813	66%	0.66	S	S	*	*			trans	-151.7	106.6	156.9	-147.9	-2.9	0	0	0	109.4	N513 T517	N513-D515 PolarHBondContact O-N 2.85Å; D515-T517 PolarHBondContact O-N 2.86Å; D515-T517 VanDerWaalsContact O-N 3.13Å
516	K	42.4	Very low	43.4	Very low	171 Å²	171	112.5 Å²	112.5	74%	0.743	64%	0.643	S	S	*	*			trans	-73.8	105.6	177.1	-74.3	-174.5	178.4	-177.4	0	107.6	K518	K516-K518 PolarHBondContact O-N 2.88Å
517	T	49.8	Very low	45.1	Very low	84 Å²	84	111 Å²	111	52%	0.515	63%	0.629	S	S	.	*			trans	-44.2	125.3	170.1	45.6	0	0	0	0	111.3	D515 L540	D515-T517 PolarHBondContact O-N 2.86Å; D515-T517 VanDerWaalsContact O-N 3.13Å; T517-L540 HydrophobicContact CG2-CD1 4.24Å; T517-L540 VanDerWaalsContact OG1-CD1 3.23Å; T517-L540 WeakPolarHBondContact OG1-CD1 3.32Å
518	K	54.8	Low	47.3	Very low	189 Å²	189	105.5 Å²	105.5	82%	0.822	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-61.1	132.4	172.2	-76.5	179	178.2	175.9	0	109.3	K516	K516-K518 PolarHBondContact O-N 2.88Å
519	P	61.8	Low	49.4	Very low	32 Å²	32	105.8 Å²	105.8	21%	0.208	58%	0.575	C	S	.	*	P	Polyproline II helix	trans	-66.9	159.3	177.6	29.6	-36.1	0	0	0	111.1	V523 P525 F528	P519-V523 HydrophobicContact CB-CB 4.35Å; P519-P525 HydrophobicContact CG-CB 3.96Å; P519-P525 HydrophobicContact CG-CG 4.01Å; P519-F528 HydrophobicContact CB-CB 4.05Å; P519-F528 HydrophobicContact CB-CD1 3.92Å; P519-F528 HydrophobicContact CB-CD2 4.14Å; P519-F528 HydrophobicContact CB-CE1 4.43Å; P519-F528 HydrophobicContact CB-CG 3.76Å
520	P	63.7	Low	50.8	Low	10 Å²	10	106.2 Å²	106.2	7%	0.065	57%	0.571	C	S	.	*	P	Polyproline II helix	trans	-56.1	149.8	173.1	-22	33	0	0	0	111.5	H522 V523 L545	P520-H522 PolarHBondContact O-N 2.84Å; P520-V523 HydrophobicContact CB-CG2 4.31Å; P520-V523 HydrophobicContact CG-CG2 4.4Å; P520-V523 PolarHBondContact O-N 3.38Å; P520-L545 HydrophobicContact CB-CD2 4.13Å; P520-L545 HydrophobicContact CG-CD2 3.9Å
521	P	50.9	Low	52.3	Low	119 Å²	119	99.5 Å²	99.5	77%	0.773	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-3.5	-167.8	18.9	-29.7	0	0	0	116.6
522	H	58.1	Low	54.3	Low	119 Å²	119	99.2 Å²	99.2	55%	0.551	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	4.2	-178.4	-45.4	-61.9	0	0	0	113.1	P520 M552	P520-H522 PolarHBondContact O-N 2.84Å; H522-M552 PolarHBondContact NE2-SD 3.26Å; H522-M552 VanDerWaalsContact NE2-SD 3.39Å
523	V	58.1	Low	55.7	Low	32 Å²	32	96.9 Å²	96.9	19%	0.194	51%	0.511	C	S	.	.	S	Bend	trans	-109.3	123.8	178.2	-174.3	0	0	0	0	108.5	P519 P520 F528	P519-V523 HydrophobicContact CB-CB 4.35Å; P520-V523 HydrophobicContact CB-CG2 4.31Å; P520-V523 HydrophobicContact CG-CG2 4.4Å; P520-V523 PolarHBondContact O-N 3.38Å; V523-F528 HydrophobicContact CG1-CB 3.99Å; V523-F528 HydrophobicContact CG1-CD2 3.96Å; V523-F528 HydrophobicContact CG1-CG 4.41Å
524	D	67.8	Low	57.3	Low	89 Å²	89	95.6 Å²	95.6	48%	0.476	50%	0.5	S	S	.	.			trans	-59.4	127.7	179.1	-177.9	-66.6	0	0	0	110.7	E526 V527 F528	D524-E526 VanDerWaalsContact C-N 3.33Å; D524-E526 PolarHBondContact O-N 3.06Å; D524-E526 WeakPolarHBondContact OD1-CA 3.45Å; D524-E526 WeakPolarHBondContact OD1-CB 3.36Å; D524-E526 PolarHBondContact OD1-N 3.42Å; D524-V527 HydrophobicContact CB-CB 4.02Å; D524-V527 HydrophobicContact CB-CG2 3.85Å; D524-V527 PolarHBondContact O-N 2.87Å; D524-V527 PolarHBondContact OD1-N 3.43Å; D524-V527 VanDerWaalsContact OD1-N 3.11Å; D524-F528 WeakPolarHBondContact O-CB 3.24Å; D524-F528 PolarHBondContact O-N 3.41Å
525	P	60.6	Low	58.3	Low	69 Å²	69	93.9 Å²	93.9	45%	0.448	48%	0.482	S	S	.	.	H	α-helix	trans	-68.8	-23.4	-174.8	-19.8	31.5	0	0	0	116.1	P519 R529	P519-P525 HydrophobicContact CG-CB 3.96Å; P519-P525 HydrophobicContact CG-CG 4.01Å; P525-R529 WeakPolarHBondContact O-CG 3.3Å; P525-R529 PolarHBondContact O-NE 3.34Å; P525-R529 VanDerWaalsContact O-NE 3.07Å
526	E	60.4	Low	59.9	Low	108 Å²	108	88.9 Å²	88.9	51%	0.505	45%	0.453	S	S	.	.	H	α-helix	trans	-78.4	-43.2	173.1	-73.2	-64.5	155.2	0	0	110	D524 F528 R529 L530	D524-E526 VanDerWaalsContact C-N 3.33Å; D524-E526 PolarHBondContact O-N 3.06Å; D524-E526 WeakPolarHBondContact OD1-CA 3.45Å; D524-E526 WeakPolarHBondContact OD1-CB 3.36Å; D524-E526 PolarHBondContact OD1-N 3.42Å; E526-F528 PolarHBondContact O-N 3.06Å; E526-R529 VanDerWaalsContact CD-CZ 3.46Å; E526-R529 PolarHBondContact O-N 3.18Å; E526-R529 IonicContact OE1-CZ 3.19Å; E526-R529 IonicContact OE1-NH1 2.95Å; E526-R529 PolarHBondContact OE1-NH1 3.39Å; E526-R529 IonicContact OE1-NH2 2.64Å; E526-R529 PolarHBondContact OE1-NH2 2.96Å; E526-R529 IonicContact OE2-CZ 3.42Å; E526-R529 IonicContact OE2-NH1 2.78Å; E526-R529 PolarHBondContact OE2-NH1 3.22Å; E526-R529 IonicContact OE2-NH2 3.6Å; E526-L530 WeakPolarHBondContact O-CG 3.48Å; E526-L530 PolarHBondContact O-N 3.38Å
527	V	59.4	Low	61.2	Low	81 Å²	81	87 Å²	87	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-64.4	-43.1	176.9	-179.3	0	0	0	0	110.9	D524 R529 L530 L531	D524-V527 HydrophobicContact CB-CB 4.02Å; D524-V527 HydrophobicContact CB-CG2 3.85Å; D524-V527 PolarHBondContact O-N 2.87Å; D524-V527 PolarHBondContact OD1-N 3.43Å; D524-V527 VanDerWaalsContact OD1-N 3.11Å; V527-R529 VanDerWaalsContact C-N 3.26Å; V527-R529 PolarHBondContact O-N 3.04Å; V527-L530 PolarHBondContact O-N 3.33Å; V527-L531 WeakPolarHBondContact O-CG 3.36Å; V527-L531 PolarHBondContact O-N 2.86Å
528	F	68.4	Low	62.3	Low	6 Å²	6	88.9 Å²	88.9	3%	0.026	45%	0.448	C	S	.	.	H	α-helix	trans	-57.9	-38.1	178.2	-173.9	-102.6	0	0	0	112.6	P519 V523 D524 E526 L530 L531 Q536 L539 L540	P519-F528 HydrophobicContact CB-CB 4.05Å; P519-F528 HydrophobicContact CB-CD1 3.92Å; P519-F528 HydrophobicContact CB-CD2 4.14Å; P519-F528 HydrophobicContact CB-CE1 4.43Å; P519-F528 HydrophobicContact CB-CG 3.76Å; V523-F528 HydrophobicContact CG1-CB 3.99Å; V523-F528 HydrophobicContact CG1-CD2 3.96Å; V523-F528 HydrophobicContact CG1-CG 4.41Å; D524-F528 WeakPolarHBondContact O-CB 3.24Å; D524-F528 PolarHBondContact O-N 3.41Å; E526-F528 PolarHBondContact O-N 3.06Å; F528-L530 VanDerWaalsContact C-N 3.26Å; F528-L530 PolarHBondContact O-N 3.32Å; F528-L531 HydrophobicContact CD2-CD1 4.24Å; F528-L531 PolarHBondContact O-N 2.96Å; F528-Q536 HydrophobicContact CE1-CB 4.26Å; F528-Q536 HydrophobicContact CE1-CG 4.16Å; F528-Q536 HydrophobicContact CE2-CB 4.18Å; F528-Q536 HydrophobicContact CE2-CG 4.21Å; F528-Q536 HydrophobicContact CZ-CB 3.74Å; F528-Q536 HydrophobicContact CZ-CG 3.97Å; F528-Q536 WeakPolarHBondContact O-CG 3.37Å; F528-Q536 PolarHBondContact O-NE2 3.13Å; F528-L539 HydrophobicContact CD2-CD1 4.04Å; F528-L539 HydrophobicContact CE2-CB 3.96Å; F528-L539 HydrophobicContact CE2-CD1 3.97Å; F528-L540 HydrophobicContact CE1-CD1 4.33Å; F528-L540 HydrophobicContact CE2-CG 4.49Å; F528-L540 HydrophobicContact CZ-CD1 3.75Å; F528-L540 HydrophobicContact CZ-CD2 4.29Å; F528-L540 HydrophobicContact CZ-CG 3.83Å
529	R	67.1	Low	62.8	Low	118 Å²	118	81 Å²	81	45%	0.445	42%	0.415	S	S	.	.	H	α-helix	trans	-71	-20	178.9	-83.9	-174	-88.7	131.8	-14.7	114.1	P525 E526 V527	P525-R529 WeakPolarHBondContact O-CG 3.3Å; P525-R529 PolarHBondContact O-NE 3.34Å; P525-R529 VanDerWaalsContact O-NE 3.07Å; E526-R529 VanDerWaalsContact CD-CZ 3.46Å; E526-R529 PolarHBondContact O-N 3.18Å; E526-R529 IonicContact OE1-CZ 3.19Å; E526-R529 IonicContact OE1-NH1 2.95Å; E526-R529 PolarHBondContact OE1-NH1 3.39Å; E526-R529 IonicContact OE1-NH2 2.64Å; E526-R529 PolarHBondContact OE1-NH2 2.96Å; E526-R529 IonicContact OE2-CZ 3.42Å; E526-R529 IonicContact OE2-NH1 2.78Å; E526-R529 PolarHBondContact OE2-NH1 3.22Å; E526-R529 IonicContact OE2-NH2 3.6Å; V527-R529 VanDerWaalsContact C-N 3.26Å; V527-R529 PolarHBondContact O-N 3.04Å
530	L	60.5	Low	63.5	Low	146 Å²	146	82.1 Å²	82.1	76%	0.764	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-5.2	178.3	-61.8	172.2	0	0	0	112.5	E526 V527 F528	E526-L530 WeakPolarHBondContact O-CG 3.48Å; E526-L530 PolarHBondContact O-N 3.38Å; V527-L530 PolarHBondContact O-N 3.33Å; F528-L530 VanDerWaalsContact C-N 3.26Å; F528-L530 PolarHBondContact O-N 3.32Å
531	L	57	Low	64.1	Low	51 Å²	51	83.1 Å²	83.1	27%	0.267	43%	0.426	S	S	.	.	S	Bend	trans	-77.2	149	177.9	-65.4	173.7	0	0	0	111.4	V527 F528 I535 Q536 L539	V527-L531 WeakPolarHBondContact O-CG 3.36Å; V527-L531 PolarHBondContact O-N 2.86Å; F528-L531 HydrophobicContact CD2-CD1 4.24Å; F528-L531 PolarHBondContact O-N 2.96Å; L531-I535 HydrophobicContact CB-CG2 4.4Å; L531-I535 HydrophobicContact CD1-CG2 4.03Å; L531-Q536 HydrophobicContact CB-CG 3.97Å; L531-Q536 PolarHBondContact O-NE2 3.31Å; L531-L539 HydrophobicContact CD1-CD1 3.65Å
532	P	67.5	Low	64.7	Low	70 Å²	70	81.7 Å²	81.7	46%	0.455	42%	0.417	S	S	.	.			trans	-54	148.3	167.4	-25.8	33.9	0	0	0	112.9	E534 I535 Q536	P532-E534 PolarHBondContact O-N 3.43Å; P532-I535 HydrophobicContact CB-CD1 4.48Å; P532-I535 HydrophobicContact CG-CD1 4.18Å; P532-I535 PolarHBondContact O-N 2.62Å; P532-I535 VanDerWaalsContact O-N 3.07Å; P532-Q536 PolarHBondContact O-N 3.17Å
533	E	61.9	Low	65.3	Low	122 Å²	122	82.3 Å²	82.3	57%	0.57	42%	0.424	S	S	*	.	H	α-helix	trans	-59.7	-32.8	-174.8	-75.5	-164.5	-175.9	0	0	113.3	I535 Q536 K537	E533-I535 VanDerWaalsContact C-N 3.31Å; E533-I535 PolarHBondContact O-N 2.86Å; E533-Q536 PolarHBondContact O-N 3.41Å; E533-K537 WeakPolarHBondContact O-CB 3.47Å; E533-K537 VanDerWaalsContact O-CG 3.26Å; E533-K537 WeakPolarHBondContact O-CG 3.34Å; E533-K537 PolarHBondContact O-N 3.39Å; E533-K537 IonicContact OE2-NZ 3.27Å; E533-K537 PolarHBondContact OE2-NZ 3.39Å
534	E	61.7	Low	66	Low	132 Å²	132	84.5 Å²	84.5	62%	0.617	43%	0.429	S	S	*	.	H	α-helix	trans	-64.6	-39.1	179.2	-60.3	72.4	-155.7	0	0	110.8	P532 K537 E538	P532-E534 PolarHBondContact O-N 3.43Å; E534-K537 PolarHBondContact O-N 3.05Å; E534-E538 WeakPolarHBondContact O-CB 3.43Å; E534-E538 PolarHBondContact O-N 2.96Å
535	I	58.7	Low	66.1	Low	71 Å²	71	83.4 Å²	83.4	36%	0.364	42%	0.423	S	S	.	.	H	α-helix	trans	-76.9	-37.3	178.8	-63.3	174.5	0	0	0	110.3	L531 P532 E533 K537 E538 L539	L531-I535 HydrophobicContact CB-CG2 4.4Å; L531-I535 HydrophobicContact CD1-CG2 4.03Å; P532-I535 HydrophobicContact CB-CD1 4.48Å; P532-I535 HydrophobicContact CG-CD1 4.18Å; P532-I535 PolarHBondContact O-N 2.62Å; P532-I535 VanDerWaalsContact O-N 3.07Å; E533-I535 VanDerWaalsContact C-N 3.31Å; E533-I535 PolarHBondContact O-N 2.86Å; I535-K537 VanDerWaalsContact C-N 3.28Å; I535-K537 PolarHBondContact O-N 3.43Å; I535-E538 PolarHBondContact O-N 2.9Å; I535-L539 HydrophobicContact CG2-CD1 4.03Å; I535-L539 HydrophobicContact CG2-CG 4.32Å; I535-L539 WeakPolarHBondContact O-CB 3.3Å; I535-L539 VanDerWaalsContact O-CG 3.29Å; I535-L539 WeakPolarHBondContact O-CG 3.43Å; I535-L539 PolarHBondContact O-N 3.39Å
536	Q	66.3	Low	66.4	Low	47 Å²	47	84.9 Å²	84.9	22%	0.22	43%	0.427	C	S	.	.	H	α-helix	trans	-59.6	-41.6	171.6	-66.4	-175.2	31.5	0	0	111.1	F528 L531 P532 E533 L540	F528-Q536 HydrophobicContact CE1-CB 4.26Å; F528-Q536 HydrophobicContact CE1-CG 4.16Å; F528-Q536 HydrophobicContact CE2-CB 4.18Å; F528-Q536 HydrophobicContact CE2-CG 4.21Å; F528-Q536 HydrophobicContact CZ-CB 3.74Å; F528-Q536 HydrophobicContact CZ-CG 3.97Å; F528-Q536 WeakPolarHBondContact O-CG 3.37Å; F528-Q536 PolarHBondContact O-NE2 3.13Å; L531-Q536 HydrophobicContact CB-CG 3.97Å; L531-Q536 PolarHBondContact O-NE2 3.31Å; P532-Q536 PolarHBondContact O-N 3.17Å; E533-Q536 PolarHBondContact O-N 3.41Å; Q536-L540 WeakPolarHBondContact O-CB 3.45Å; Q536-L540 VanDerWaalsContact O-CG 3.29Å; Q536-L540 WeakPolarHBondContact O-CG 3.34Å; Q536-L540 PolarHBondContact O-N 3.4Å
537	K	70.2	Confident	66.8	Low	131 Å²	131	83.5 Å²	83.5	57%	0.57	43%	0.43	S	S	*	.	H	α-helix	trans	-67.6	-38.8	176.1	-73.8	167.5	-171.8	159.4	0	112.5	E533 E534 I535 L540 S541	E533-K537 WeakPolarHBondContact O-CB 3.47Å; E533-K537 VanDerWaalsContact O-CG 3.26Å; E533-K537 WeakPolarHBondContact O-CG 3.34Å; E533-K537 PolarHBondContact O-N 3.39Å; E533-K537 IonicContact OE2-NZ 3.27Å; E533-K537 PolarHBondContact OE2-NZ 3.39Å; E534-K537 PolarHBondContact O-N 3.05Å; I535-K537 VanDerWaalsContact C-N 3.28Å; I535-K537 PolarHBondContact O-N 3.43Å; K537-L540 PolarHBondContact O-N 3.01Å; K537-S541 PolarHBondContact O-N 3.3Å; K537-S541 VanDerWaalsContact O-N 3.08Å
538	E	74.3	Confident	66.7	Low	124 Å²	124	81.7 Å²	81.7	58%	0.579	42%	0.417	S	S	*	.	H	α-helix	trans	-65.6	-43.8	176.4	-171.1	-178.9	169.6	0	0	112.1	E534 I535 L540 S541 Y544	E534-E538 WeakPolarHBondContact O-CB 3.43Å; E534-E538 PolarHBondContact O-N 2.96Å; I535-E538 PolarHBondContact O-N 2.9Å; E538-L540 VanDerWaalsContact C-N 3.26Å; E538-L540 PolarHBondContact O-N 3.3Å; E538-S541 WeakPolarHBondContact O-CB 3.4Å; E538-S541 PolarHBondContact O-N 3.16Å; E538-S541 PolarHBondContact O-OG 3.22Å; E538-Y544 WeakPolarHBondContact O-CB 3.44Å
539	L	64.9	Low	66.3	Low	25 Å²	25	88.3 Å²	88.3	13%	0.131	45%	0.448	C	S	.	.	H	α-helix	trans	-69.6	-22.5	178.5	-70.9	174.9	0	0	0	113.6	F528 L531 I535 Y544	F528-L539 HydrophobicContact CD2-CD1 4.04Å; F528-L539 HydrophobicContact CE2-CB 3.96Å; F528-L539 HydrophobicContact CE2-CD1 3.97Å; L531-L539 HydrophobicContact CD1-CD1 3.65Å; I535-L539 HydrophobicContact CG2-CD1 4.03Å; I535-L539 HydrophobicContact CG2-CG 4.32Å; I535-L539 WeakPolarHBondContact O-CB 3.3Å; I535-L539 VanDerWaalsContact O-CG 3.29Å; I535-L539 WeakPolarHBondContact O-CG 3.43Å; I535-L539 PolarHBondContact O-N 3.39Å; L539-Y544 HydrophobicContact CD2-CD1 4.16Å; L539-Y544 HydrophobicContact CD2-CD2 4.37Å; L539-Y544 HydrophobicContact CD2-CE1 3.6Å; L539-Y544 HydrophobicContact CD2-CE2 3.84Å; L539-Y544 VanDerWaalsContact CD2-CZ 3.42Å; L539-Y544 VanDerWaalsContact O-CD1 3.26Å; L539-Y544 WeakPolarHBondContact O-CD1 3.19Å
540	L	75	Confident	65.8	Low	55 Å²	55	85.4 Å²	85.4	29%	0.288	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	0.1	172.1	-65.9	171.3	0	0	0	112.5	T517 F528 Q536 K537 E538	T517-L540 HydrophobicContact CG2-CD1 4.24Å; T517-L540 VanDerWaalsContact OG1-CD1 3.23Å; T517-L540 WeakPolarHBondContact OG1-CD1 3.32Å; F528-L540 HydrophobicContact CE1-CD1 4.33Å; F528-L540 HydrophobicContact CE2-CG 4.49Å; F528-L540 HydrophobicContact CZ-CD1 3.75Å; F528-L540 HydrophobicContact CZ-CD2 4.29Å; F528-L540 HydrophobicContact CZ-CG 3.83Å; Q536-L540 WeakPolarHBondContact O-CB 3.45Å; Q536-L540 VanDerWaalsContact O-CG 3.29Å; Q536-L540 WeakPolarHBondContact O-CG 3.34Å; Q536-L540 PolarHBondContact O-N 3.4Å; K537-L540 PolarHBondContact O-N 3.01Å; E538-L540 VanDerWaalsContact C-N 3.26Å; E538-L540 PolarHBondContact O-N 3.3Å
541	S	76.8	Confident	65.4	Low	30 Å²	30	86.1 Å²	86.1	21%	0.21	44%	0.44	C	S	.	.	S	Bend	trans	-68	145.4	-178.8	73.7	0	0	0	0	111.2	K537 E538 D543 Y544 L545	K537-S541 PolarHBondContact O-N 3.3Å; K537-S541 VanDerWaalsContact O-N 3.08Å; E538-S541 WeakPolarHBondContact O-CB 3.4Å; E538-S541 PolarHBondContact O-N 3.16Å; E538-S541 PolarHBondContact O-OG 3.22Å; S541-D543 PolarHBondContact O-N 3.15Å; S541-Y544 PolarHBondContact O-N 3.17Å; S541-Y544 WeakPolarHBondContact OG-CB 3.37Å; S541-Y544 PolarHBondContact OG-N 3.13Å; S541-L545 PolarHBondContact O-N 3.02Å; S541-L545 VanDerWaalsContact O-N 3.09Å
542	P	64.3	Low	65.2	Low	90 Å²	90	88.7 Å²	88.7	58%	0.584	45%	0.451	S	S	*	.	H	α-helix	trans	-56.8	-35.6	175.7	-24	33.4	0	0	0	112.5	L545 N546	P542-L545 PolarHBondContact O-N 3.4Å; P542-N546 WeakPolarHBondContact O-CB 3.45Å; P542-N546 PolarHBondContact O-N 3.43Å; P542-N546 PolarHBondContact O-ND2 2.89Å
543	D	69.8	Low	64.4	Low	131 Å²	131	89.9 Å²	89.9	70%	0.701	46%	0.461	S	S	*	.	H	α-helix	trans	-66.4	-41.9	-179.2	-67	-23	0	0	0	111.9	S541 S547	S541-D543 PolarHBondContact O-N 3.15Å; D543-S547 VanDerWaalsContact O-CB 3.28Å; D543-S547 WeakPolarHBondContact O-CB 3.36Å; D543-S547 PolarHBondContact O-N 2.9Å
544	Y	72.4	Confident	63.6	Low	78 Å²	78	91.5 Å²	91.5	31%	0.306	47%	0.467	S	S	.	.	H	α-helix	trans	-67.3	-45.8	175.8	-177.5	-98.2	0	0	0	111.7	E538 L539 S541 N546 S547 L548	E538-Y544 WeakPolarHBondContact O-CB 3.44Å; L539-Y544 HydrophobicContact CD2-CD1 4.16Å; L539-Y544 HydrophobicContact CD2-CD2 4.37Å; L539-Y544 HydrophobicContact CD2-CE1 3.6Å; L539-Y544 HydrophobicContact CD2-CE2 3.84Å; L539-Y544 VanDerWaalsContact CD2-CZ 3.42Å; L539-Y544 VanDerWaalsContact O-CD1 3.26Å; L539-Y544 WeakPolarHBondContact O-CD1 3.19Å; S541-Y544 PolarHBondContact O-N 3.17Å; S541-Y544 WeakPolarHBondContact OG-CB 3.37Å; S541-Y544 PolarHBondContact OG-N 3.13Å; Y544-N546 PolarHBondContact O-N 3.03Å; Y544-S547 WeakPolarHBondContact O-CB 3.25Å; Y544-S547 PolarHBondContact O-N 3.24Å; Y544-L548 HydrophobicContact CE1-CD1 3.81Å; Y544-L548 HydrophobicContact CE2-CD1 4.35Å; Y544-L548 PolarHBondContact O-N 2.6Å
545	L	71.1	Confident	62.6	Low	66 Å²	66	91.6 Å²	91.6	35%	0.346	47%	0.467	S	S	.	.	H	α-helix	trans	-64.4	-39.8	179.6	-68.5	175.1	0	0	0	112.2	P520 S541 P542 L548 Q549	P520-L545 HydrophobicContact CB-CD2 4.13Å; P520-L545 HydrophobicContact CG-CD2 3.9Å; S541-L545 PolarHBondContact O-N 3.02Å; S541-L545 VanDerWaalsContact O-N 3.09Å; P542-L545 PolarHBondContact O-N 3.4Å; L545-L548 PolarHBondContact O-N 3.3Å; L545-Q549 WeakPolarHBondContact O-CB 3.37Å; L545-Q549 PolarHBondContact O-N 3.37Å
546	N	67.3	Low	61.4	Low	100 Å²	100	96 Å²	96	54%	0.535	49%	0.486	S	S	.	.	H	α-helix	trans	-67.2	-38.5	175.2	-72.9	-28.6	0	0	0	112.1	P542 Y544 Q549 S550	P542-N546 WeakPolarHBondContact O-CB 3.45Å; P542-N546 PolarHBondContact O-N 3.43Å; P542-N546 PolarHBondContact O-ND2 2.89Å; Y544-N546 PolarHBondContact O-N 3.03Å; N546-Q549 PolarHBondContact O-N 3.27Å; N546-S550 WeakPolarHBondContact O-CB 3.41Å; N546-S550 PolarHBondContact O-N 2.92Å
547	S	67.3	Low	59.9	Low	79 Å²	79	98.9 Å²	98.9	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-63.1	-42.6	173.6	-175.7	0	0	0	0	111.5	D543 Y544 S550 Y551	D543-S547 VanDerWaalsContact O-CB 3.28Å; D543-S547 WeakPolarHBondContact O-CB 3.36Å; D543-S547 PolarHBondContact O-N 2.9Å; Y544-S547 WeakPolarHBondContact O-CB 3.25Å; Y544-S547 PolarHBondContact O-N 3.24Å; S547-S550 PolarHBondContact O-N 3.12Å; S547-Y551 WeakPolarHBondContact O-CB 3.26Å; S547-Y551 PolarHBondContact O-N 3.32Å
548	L	59.2	Low	58.1	Low	44 Å²	44	98.7 Å²	98.7	23%	0.23	52%	0.521	C	S	.	.	H	α-helix	trans	-63.7	-42.9	176.8	-139	92	0	0	0	111.8	Y544 L545 S550 Y551 M552	Y544-L548 HydrophobicContact CE1-CD1 3.81Å; Y544-L548 HydrophobicContact CE2-CD1 4.35Å; Y544-L548 PolarHBondContact O-N 2.6Å; L545-L548 PolarHBondContact O-N 3.3Å; L548-S550 VanDerWaalsContact C-N 3.35Å; L548-Y551 WeakPolarHBondContact O-CB 3.43Å; L548-Y551 PolarHBondContact O-N 2.99Å; L548-Y551 VanDerWaalsContact O-N 3.1Å; L548-M552 WeakPolarHBondContact O-CG 3.45Å; L548-M552 PolarHBondContact O-N 3.16Å
549	Q	58.1	Low	56.1	Low	144 Å²	144	102.2 Å²	102.2	67%	0.673	54%	0.537	S	S	*	.	H	α-helix	trans	-67.8	-36.3	178.4	-163.6	144.3	2.7	0	0	111.8	L545 N546 Y551 S553	L545-Q549 WeakPolarHBondContact O-CB 3.37Å; L545-Q549 PolarHBondContact O-N 3.37Å; N546-Q549 PolarHBondContact O-N 3.27Å; Q549-Y551 VanDerWaalsContact C-N 3.29Å; Q549-Y551 PolarHBondContact O-N 3.45Å; Q549-S553 WeakPolarHBondContact O-CB 3.48Å; Q549-S553 PolarHBondContact O-N 3.47Å
550	S	57	Low	54.5	Low	58 Å²	58	109 Å²	109	41%	0.406	57%	0.574	S	S	.	*	H	α-helix	trans	-65.7	-30.2	170.1	178.8	0	0	0	0	112.9	N546 S547 L548 K554	N546-S550 WeakPolarHBondContact O-CB 3.41Å; N546-S550 PolarHBondContact O-N 2.92Å; S547-S550 PolarHBondContact O-N 3.12Å; L548-S550 VanDerWaalsContact C-N 3.35Å; S550-K554 WeakPolarHBondContact O-CD 3.38Å; S550-K554 WeakPolarHBondContact O-CG 3.4Å
551	Y	53.4	Low	52.3	Low	160 Å²	160	113.6 Å²	113.6	63%	0.627	60%	0.598	S	S	*	*	H	α-helix	trans	-75.5	-43.3	177.9	-166.3	-93.5	0	0	0	111.3	S547 L548 Q549 K554	S547-Y551 WeakPolarHBondContact O-CB 3.26Å; S547-Y551 PolarHBondContact O-N 3.32Å; L548-Y551 WeakPolarHBondContact O-CB 3.43Å; L548-Y551 PolarHBondContact O-N 2.99Å; L548-Y551 VanDerWaalsContact O-N 3.1Å; Q549-Y551 VanDerWaalsContact C-N 3.29Å; Q549-Y551 PolarHBondContact O-N 3.45Å; Y551-K554 PolarHBondContact O-N 2.87Å
552	M	52.1	Low	50.1	Low	105 Å²	105	116.7 Å²	116.7	52%	0.517	62%	0.62	S	S	.	*	H	α-helix	trans	-67.1	-37.8	176.9	-66.9	-156.3	74.9	0	0	112.6	H522 L548 K554 H555	H522-M552 PolarHBondContact NE2-SD 3.26Å; H522-M552 VanDerWaalsContact NE2-SD 3.39Å; L548-M552 WeakPolarHBondContact O-CG 3.45Å; L548-M552 PolarHBondContact O-N 3.16Å; M552-K554 PolarHBondContact O-N 3.33Å; M552-H555 PolarHBondContact O-N 3.12Å
553	S	49.7	Very low	48.3	Very low	95 Å²	95	117.2 Å²	117.2	66%	0.664	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-14.5	176.1	-163.9	0	0	0	0	113.7	Q549	Q549-S553 WeakPolarHBondContact O-CB 3.48Å; Q549-S553 PolarHBondContact O-N 3.47Å
554	K	45.3	Very low	46.3	Very low	157 Å²	157	118.7 Å²	118.7	68%	0.683	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-8.5	175.3	-77.7	175.1	-177.7	171.4	0	113.6	S550 Y551 M552	S550-K554 WeakPolarHBondContact O-CD 3.38Å; S550-K554 WeakPolarHBondContact O-CG 3.4Å; Y551-K554 PolarHBondContact O-N 2.87Å; M552-K554 PolarHBondContact O-N 3.33Å
555	H	41.8	Very low	44.2	Very low	134 Å²	134	124 Å²	124	62%	0.62	66%	0.655	S	S	*	*	S	Bend	trans	-131.2	40.5	-173.8	-76.7	-65.8	0	0	0	112.6	M552	M552-H555 PolarHBondContact O-N 3.12Å
556	E	33.3	Very low	42.2	Very low	164 Å²	164	125.6 Å²	125.6	77%	0.766	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-88.7	129.6	166.8	-110.6	174.9	176.9	0	0	110.7
557	P	33.7	Very low	40.2	Very low	106 Å²	106	128.6 Å²	128.6	69%	0.688	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-76.9	150.2	170	31.7	-30.2	0	0	0	110.3	E559	P557-E559 PolarHBondContact O-N 2.96Å
558	P	33.7	Very low	38.4	Very low	128 Å²	128	135.9 Å²	135.9	83%	0.831	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-69.9	132	-176.1	27.9	-33	0	0	0	111.7
559	E	32.8	Very low	36.9	Very low	197 Å²	197	139 Å²	139	92%	0.921	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-62.1	130	166.4	-68.6	-171.5	150.8	0	0	110	P557	P557-E559 PolarHBondContact O-N 2.96Å
560	N	30	Very low	35.5	Very low	169 Å²	169	143.1 Å²	143.1	90%	0.904	75%	0.745	S	S	*	*			trans	-108.8	127.4	167.1	-141.2	13	0	0	0	108.3
561	D	29.2	Very low	34.1	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	77%	0.765	S	S	*	*			trans	-72.8	166.6	-172.6	-164.2	7.2	0	0	0	112.9
562	S	30	Very low	32.9	Very low	96 Å²	96	147.4 Å²	147.4	67%	0.671	77%	0.771	S	S	*	*			trans	97.2	102.6	162	78.3	0	0	0	0	120
563	S	26.7	Very low	31.8	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	78%	0.779	S	S	*	*				45.3	115	127	73.5	0	0	0	0	120.2
564	M	27.6	Very low	30.7	Very low	162 Å²	162	153.2 Å²	153.2	80%	0.798	79%	0.786	S	S	*	*				161.4	119.6	104	-86	-151.1	163.7	0	0	111.7
565	K	28.1	Very low	29.7	Very low	189 Å²	189	154.5 Å²	154.5	82%	0.822	79%	0.794	S	S	*	*			trans	42.4	112	138.9	-62.6	-176.1	179	179.4	0	120
566	A	29.2	Very low	29.6	Very low	101 Å²	101	153.4 Å²	153.4	84%	0.835	80%	0.799	S	S	*	*			trans	3	130.9	138.1	0	0	0	0	0	118.9
567	D	26.9	Very low	29.1	Very low	163 Å²	163	150.7 Å²	150.7	87%	0.872	80%	0.804	S	S	*	*				-151.1	145.4	124.3	-142.6	-13.9	0	0	0	113.6
568	R	27.9	Very low	28.7	Very low	231 Å²	231	149.4 Å²	149.4	87%	0.872	81%	0.811	S	S	*	*			trans	-94.2	141.4	179.5	-73.4	171.3	164	-175.2	-4.3	109.7
569	S	28.6	Very low	28.2	Very low	111 Å²	111	151.7 Å²	151.7	78%	0.776	81%	0.812	S	S	*	*			trans	178.5	119.2	140.7	36	0	0	0	0	111.3
570	R	28.6	Very low	27.9	Very low	230 Å²	230	152.8 Å²	152.8	87%	0.868	81%	0.808	S	S	*	*				66.9	100.5	104.6	-105	178.7	175.1	178.3	-1.5	114.1
571	M	27	Very low	27.6	Very low	167 Å²	167	149.8 Å²	149.8	82%	0.823	80%	0.796	S	S	*	*				50.2	117.6	103	-64.7	-179.7	100.1	0	0	114.2
572	N	27.8	Very low	27.5	Very low	140 Å²	140	150.1 Å²	150.1	75%	0.749	80%	0.796	S	S	*	*				176.7	171.7	91.4	-131.8	-3	0	0	0	113.8
573	H	29	Very low	27.5	Very low	149 Å²	149	151.7 Å²	151.7	69%	0.69	80%	0.797	S	S	*	*			trans	-52.8	160	-171.3	-70.4	-44.7	0	0	0	122.2
574	Q	26.7	Very low	27.6	Very low	174 Å²	174	154 Å²	154	81%	0.813	80%	0.797	S	S	*	*			trans	97.1	112.4	133.2	-94.9	150	-13	0	0	120.6
575	Q	25.5	Very low	27.9	Very low	184 Å²	184	154.4 Å²	154.4	86%	0.86	80%	0.797	S	S	*	*			trans	2.7	165	144.1	-77.4	-175.3	-5.5	0	0	120.3
576	P	38.8	Very low	28.2	Very low	110 Å²	110	151.4 Å²	151.4	71%	0.714	79%	0.789	S	S	*	*			cis	-139.8	-178.6	7.2	25.7	0.3	0	0	0	116
577	A	23.9	Very low	28.4	Very low	107 Å²	107	150.3 Å²	150.3	88%	0.884	77%	0.772	S	S	*	*			trans	65.4	132.7	151.8	0	0	0	0	0	120.2
578	G	24.1	Very low	28.6	Very low	80 Å²	80	149 Å²	149	83%	0.825	76%	0.762	S	S	*	*			trans	145.7	108.6	158.7	0	0	0	0	0	115.8
579	M	23.6	Very low	29.1	Very low	175 Å²	175	144.9 Å²	144.9	86%	0.862	75%	0.753	S	S	*	*			trans	-64.8	161.7	164.6	-94.8	147.4	50.3	0	0	113.6
580	R	26.1	Very low	29.5	Very low	220 Å²	220	146.5 Å²	146.5	83%	0.83	75%	0.748	S	S	*	*			trans	80.9	142.6	167.4	-57.8	-177	170.8	-167.7	-3.1	114.6
581	V	24.5	Very low	29.7	Very low	106 Å²	106	141.2 Å²	141.2	64%	0.642	73%	0.733	S	S	*	*			cis	-156.9	137.8	33.9	174.2	0	0	0	0	107.7
582	I	26.6	Very low	30.1	Very low	157 Å²	157	141.2 Å²	141.2	81%	0.805	73%	0.729	S	S	*	*	S	Bend	trans	-142.2	117.2	145.4	-48.3	178.7	0	0	0	109.5
583	N	29.9	Very low	30.6	Very low	130 Å²	130	140 Å²	140	70%	0.695	72%	0.722	S	S	*	*			trans	76	87.7	158	-64.5	1	0	0	0	120.8	E585	N583-E585 VanDerWaalsContact C-N 3.31Å; N583-E585 PolarHBondContact O-N 2.57Å
584	E	28.7	Very low	30.8	Very low	149 Å²	149	142.4 Å²	142.4	70%	0.696	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	7.3	169.9	-75.9	179.6	153.4	0	0	115.4
585	E	33.6	Very low	31.2	Very low	170 Å²	170	140.2 Å²	140.2	79%	0.794	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-22.4	-178.7	-73.8	-173.8	156.9	0	0	114.2	N583	N583-E585 VanDerWaalsContact C-N 3.31Å; N583-E585 PolarHBondContact O-N 2.57Å
586	N	36	Very low	31.7	Very low	125 Å²	125	136 Å²	136	67%	0.668	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-13.4	178.9	-95.6	-8	0	0	0	114.7
587	V	32.6	Very low	31.7	Very low	78 Å²	78	134.5 Å²	134.5	47%	0.473	70%	0.695	S	S	.	*	H	α-helix	trans	-84	-31.6	-176.4	-177.6	0	0	0	0	111.3	E589 Q590 E591	V587-E589 PolarHBondContact O-N 3.15Å; V587-Q590 PolarHBondContact O-N 3.03Å; V587-E591 PolarHBondContact O-N 3.04Å
588	M	30.9	Very low	32.3	Very low	135 Å²	135	133.1 Å²	133.1	67%	0.665	68%	0.679	S	S	*	*	H	α-helix	trans	-72.9	-25.3	178.7	-79.8	-145.7	-64.9	0	0	114.4	K592	M588-K592 WeakPolarHBondContact O-CB 3.34Å; M588-K592 PolarHBondContact O-N 3.3Å
589	E	39.2	Very low	33.1	Very low	146 Å²	146	133.6 Å²	133.6	68%	0.682	67%	0.669	S	S	*	*	H	α-helix	trans	-77.5	-35.6	173.8	-95.8	-172.4	159.5	0	0	112.2	V587 L593	V587-E589 PolarHBondContact O-N 3.15Å; E589-L593 PolarHBondContact O-N 3.25Å; E589-L593 VanDerWaalsContact O-N 3.13Å
590	Q	35.6	Very low	34	Very low	145 Å²	145	133.1 Å²	133.1	68%	0.678	67%	0.67	S	S	*	*	H	α-helix	trans	-71.1	-40.8	175.1	-78	-175.2	-22.6	0	0	112.4	V587 L593 W594	V587-Q590 PolarHBondContact O-N 3.03Å; Q590-L593 PolarHBondContact O-N 3.4Å; Q590-W594 PolarHBondContact O-N 2.94Å
591	E	34.2	Very low	34.8	Very low	118 Å²	118	124.7 Å²	124.7	55%	0.551	64%	0.644	S	S	*	*	H	α-helix	trans	-67.9	-34.9	176.1	-79.9	-173.1	154.3	0	0	112.8	V587 W594 L595	V587-E591 PolarHBondContact O-N 3.04Å; E591-W594 PolarHBondContact O-N 2.82Å; E591-L595 WeakPolarHBondContact O-CB 3.37Å; E591-L595 WeakPolarHBondContact O-CG 3.41Å; E591-L595 PolarHBondContact O-N 3.07Å
592	K	34.9	Very low	36	Very low	167 Å²	167	127.2 Å²	127.2	73%	0.726	66%	0.655	S	S	*	*	H	α-helix	trans	-66.7	-35.4	172	-93.8	-179.7	176.9	174.4	0	112.8	M588 S596	M588-K592 WeakPolarHBondContact O-CB 3.34Å; M588-K592 PolarHBondContact O-N 3.3Å; K592-S596 VanDerWaalsContact O-CB 3.26Å; K592-S596 WeakPolarHBondContact O-CB 3.34Å; K592-S596 PolarHBondContact O-N 2.9Å
593	L	37.7	Very low	37.4	Very low	115 Å²	115	123.6 Å²	123.6	60%	0.602	63%	0.633	S	S	*	*	H	α-helix	trans	-68.1	-40.4	175.3	-139.4	89.5	0	0	0	111.1	E589 Q590 S596 L597	E589-L593 PolarHBondContact O-N 3.25Å; E589-L593 VanDerWaalsContact O-N 3.13Å; Q590-L593 PolarHBondContact O-N 3.4Å; L593-S596 PolarHBondContact O-N 2.93Å; L593-L597 VanDerWaalsContact O-CD1 3.32Å; L593-L597 WeakPolarHBondContact O-CD1 3.31Å; L593-L597 VanDerWaalsContact O-CG 3.28Å; L593-L597 WeakPolarHBondContact O-CG 3.36Å; L593-L597 PolarHBondContact O-N 3.24Å
594	W	34.5	Very low	38.9	Very low	199 Å²	199	119.4 Å²	119.4	75%	0.754	61%	0.613	S	S	*	*	H	α-helix	trans	-70.1	-43.4	179.9	-125.9	71.5	0	0	0	112.9	Q590 E591 S596 L597 S598	Q590-W594 PolarHBondContact O-N 2.94Å; E591-W594 PolarHBondContact O-N 2.82Å; W594-S596 PolarHBondContact O-N 3.22Å; W594-L597 PolarHBondContact O-N 2.72Å; W594-L597 VanDerWaalsContact O-N 3.13Å; W594-S598 PolarHBondContact O-N 2.71Å
595	L	34.1	Very low	39.9	Very low	128 Å²	128	116.7 Å²	116.7	67%	0.67	63%	0.625	S	S	*	*	H	α-helix	trans	-69.9	-20.2	175.8	-75.6	160.6	0	0	0	113.2	E591 S598	E591-L595 WeakPolarHBondContact O-CB 3.37Å; E591-L595 WeakPolarHBondContact O-CG 3.41Å; E591-L595 PolarHBondContact O-N 3.07Å; L595-S598 PolarHBondContact O-OG 3.04Å
596	S	35.8	Very low	40.8	Very low	97 Å²	97	112.2 Å²	112.2	68%	0.678	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-16.1	171.9	176.9	0	0	0	0	113.4	K592 L593 W594	K592-S596 VanDerWaalsContact O-CB 3.26Å; K592-S596 WeakPolarHBondContact O-CB 3.34Å; K592-S596 PolarHBondContact O-N 2.9Å; L593-S596 PolarHBondContact O-N 2.93Å; W594-S596 PolarHBondContact O-N 3.22Å
597	L	40.2	Very low	41.8	Very low	77 Å²	77	108 Å²	108	40%	0.403	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.4	-14.8	-177.8	-74.5	164	0	0	0	112.8	L593 W594 S599 C601	L593-L597 VanDerWaalsContact O-CD1 3.32Å; L593-L597 WeakPolarHBondContact O-CD1 3.31Å; L593-L597 VanDerWaalsContact O-CG 3.28Å; L593-L597 WeakPolarHBondContact O-CG 3.36Å; L593-L597 PolarHBondContact O-N 3.24Å; W594-L597 PolarHBondContact O-N 2.72Å; W594-L597 VanDerWaalsContact O-N 3.13Å; L597-S599 VanDerWaalsContact C-N 3.26Å; L597-S599 PolarHBondContact O-N 2.8Å; L597-C601 WeakPolarHBondContact CD2-SG 3.31Å
598	S	35.6	Very low	43.4	Very low	79 Å²	79	108.3 Å²	108.3	55%	0.552	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	7.3	-173.6	60.8	0	0	0	0	115.8	W594 L595	W594-S598 PolarHBondContact O-N 2.71Å; L595-S598 PolarHBondContact O-OG 3.04Å
599	S	40.5	Very low	44.9	Very low	90 Å²	90	105.5 Å²	105.5	63%	0.629	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	10.8	-172	-49.7	0	0	0	0	116.9	L597	L597-S599 VanDerWaalsContact C-N 3.26Å; L597-S599 PolarHBondContact O-N 2.8Å
600	D	42.2	Very low	46	Very low	165 Å²	165	105.6 Å²	105.6	88%	0.882	58%	0.576	S	S	*	*	S	Bend	trans	173.1	62.3	159.4	-89.3	-27.1	0	0	0	112.1
601	C	42.5	Very low	47.2	Very low	42 Å²	42	101.4 Å²	101.4	28%	0.284	56%	0.561	S	S	.	*			trans	-112.4	99.7	171.6	-71.2	0	0	0	0	110.8	L597 F603	L597-C601 WeakPolarHBondContact CD2-SG 3.31Å; C601-F603 HydrophobicContact CB-CE2 4.37Å; C601-F603 PolarHBondContact O-N 2.92Å; C601-F603 VanDerWaalsContact O-N 3.07Å
602	N	51.1	Low	49	Very low	160 Å²	160	96.9 Å²	96.9	86%	0.856	54%	0.539	S	S	*	.			trans	-72.4	95.3	170	-90.3	-22.7	0	0	0	109.7
603	F	54.8	Low	50.4	Low	80 Å²	80	92.3 Å²	92.3	35%	0.351	53%	0.528	S	S	.	.			trans	-64.3	141.1	162.4	-65.4	-84.6	0	0	0	109.3	C601 G605 F612 W627	C601-F603 HydrophobicContact CB-CE2 4.37Å; C601-F603 PolarHBondContact O-N 2.92Å; C601-F603 VanDerWaalsContact O-N 3.07Å; F603-G605 PolarHBondContact O-N 2.96Å; F603-F612 HydrophobicContact CE1-CD1 4.11Å; F603-F612 HydrophobicContact CE1-CE1 4.42Å; F603-W627 HydrophobicContact CD1-CZ3 4.25Å
604	P	63	Low	51.8	Low	42 Å²	42	94.8 Å²	94.8	27%	0.273	54%	0.537	S	S	.	.			trans	-55.9	135.4	166.7	-20.1	31.5	0	0	0	109.2	N606 V607 W627	P604-N606 PolarHBondContact O-N 2.77Å; P604-V607 HydrophobicContact CB-CG2 4.19Å; P604-V607 HydrophobicContact CG-CG2 4.27Å; P604-V607 PolarHBondContact O-N 3.47Å; P604-W627 HydrophobicContact CG-CD2 3.9Å; P604-W627 HydrophobicContact CG-CE3 4.29Å; P604-W627 HydrophobicContact CG-CG 4.03Å
605	G	48.1	Very low	53.1	Low	92 Å²	92	87.9 Å²	87.9	95%	0.948	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	9	-168	0	0	0	0	0	117.2	F603	F603-G605 PolarHBondContact O-N 2.96Å
606	N	52.8	Low	55	Low	77 Å²	77	85.4 Å²	85.4	41%	0.412	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	17.6	-179	65.7	-63.2	0	0	0	112.5	P604 L666	P604-N606 PolarHBondContact O-N 2.77Å; N606-L666 WeakPolarHBondContact ND2-CD2 3.18Å
607	V	57.2	Low	56.3	Low	36 Å²	36	85.4 Å²	85.4	22%	0.218	50%	0.504	C	S	.	.			trans	-109.9	125.4	174.4	178.7	0	0	0	0	108.9	P604 P609 F612 W627	P604-V607 HydrophobicContact CB-CG2 4.19Å; P604-V607 HydrophobicContact CG-CG2 4.27Å; P604-V607 PolarHBondContact O-N 3.47Å; V607-P609 WeakPolarHBondContact O-CD 3.34Å; V607-F612 HydrophobicContact CG1-CB 4.29Å; V607-W627 HydrophobicContact CB-CH2 4.45Å; V607-W627 HydrophobicContact CG1-CH2 3.82Å; V607-W627 HydrophobicContact CG1-CZ3 4.46Å; V607-W627 HydrophobicContact CG2-CH2 3.96Å; V607-W627 HydrophobicContact CG2-CZ2 3.95Å
608	D	66.4	Low	57	Low	85 Å²	85	88.1 Å²	88.1	46%	0.455	52%	0.519	S	S	.	.			trans	-78.6	120.8	173.7	-169	-37.1	0	0	0	109.9	E610 V611 F612	D608-E610 VanDerWaalsContact C-N 3.3Å; D608-E610 PolarHBondContact O-N 3.07Å; D608-E610 PolarHBondContact OD1-N 3.24Å; D608-V611 HydrophobicContact CB-CB 4.14Å; D608-V611 HydrophobicContact CB-CG2 3.93Å; D608-V611 PolarHBondContact O-N 2.95Å; D608-F612 PolarHBondContact O-N 3.09Å; D608-F612 VanDerWaalsContact O-N 3.08Å
609	P	63.1	Low	57.9	Low	75 Å²	75	87 Å²	87	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-32.2	-179.5	-22.6	34.1	0	0	0	114.2	V607 S613	V607-P609 WeakPolarHBondContact O-CD 3.34Å; P609-S613 PolarHBondContact O-N 2.92Å; P609-S613 VanDerWaalsContact O-N 3.14Å
610	E	60.9	Low	59.4	Low	149 Å²	149	85 Å²	85	70%	0.696	49%	0.489	S	S	*	.	H	α-helix	trans	-69.8	-47	-179.8	-72.1	-174.5	170.1	0	0	110.1	D608 F612 S613 E614	D608-E610 VanDerWaalsContact C-N 3.3Å; D608-E610 PolarHBondContact O-N 3.07Å; D608-E610 PolarHBondContact OD1-N 3.24Å; E610-F612 VanDerWaalsContact C-N 3.3Å; E610-F612 PolarHBondContact O-N 3.34Å; E610-S613 WeakPolarHBondContact O-CB 3.14Å; E610-S613 PolarHBondContact O-N 3.01Å; E610-S613 VanDerWaalsContact O-N 3.09Å; E610-S613 PolarHBondContact O-OG 3.41Å; E610-E614 PolarHBondContact O-N 2.71Å
611	V	62.5	Low	60.5	Low	57 Å²	57	84.9 Å²	84.9	35%	0.345	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-36.5	177.4	-179.5	0	0	0	0	111.7	D608 S613 E614 F669	D608-V611 HydrophobicContact CB-CB 4.14Å; D608-V611 HydrophobicContact CB-CG2 3.93Å; D608-V611 PolarHBondContact O-N 2.95Å; V611-S613 VanDerWaalsContact C-N 3.31Å; V611-S613 PolarHBondContact O-N 3.21Å; V611-E614 PolarHBondContact O-N 2.69Å; V611-F669 HydrophobicContact CG1-CD1 4.14Å; V611-F669 HydrophobicContact CG1-CE1 3.8Å
612	F	70.7	Confident	61.5	Low	22 Å²	22	88.8 Å²	88.8	10%	0.096	50%	0.495	C	S	.	.	H	α-helix	trans	-64.7	-36.8	175.5	-178.2	-96.3	0	0	0	112.1	F603 V607 D608 E610 E614 L615 Q620 L623 M624 W627	F603-F612 HydrophobicContact CE1-CD1 4.11Å; F603-F612 HydrophobicContact CE1-CE1 4.42Å; V607-F612 HydrophobicContact CG1-CB 4.29Å; D608-F612 PolarHBondContact O-N 3.09Å; D608-F612 VanDerWaalsContact O-N 3.08Å; E610-F612 VanDerWaalsContact C-N 3.3Å; E610-F612 PolarHBondContact O-N 3.34Å; F612-E614 VanDerWaalsContact C-N 3.28Å; F612-E614 PolarHBondContact O-N 3.48Å; F612-L615 HydrophobicContact CD2-CD1 4.11Å; F612-L615 WeakPolarHBondContact O-CB 3.42Å; F612-L615 PolarHBondContact O-N 3.44Å; F612-Q620 HydrophobicContact CE1-CB 4Å; F612-Q620 HydrophobicContact CE1-CG 4Å; F612-Q620 HydrophobicContact CE2-CB 4.35Å; F612-Q620 HydrophobicContact CE2-CG 4.43Å; F612-Q620 HydrophobicContact CZ-CB 3.63Å; F612-Q620 HydrophobicContact CZ-CG 3.93Å; F612-Q620 PolarHBondContact O-NE2 3.28Å; F612-L623 HydrophobicContact CD2-CD1 4.45Å; F612-L623 HydrophobicContact CE2-CB 4.03Å; F612-L623 HydrophobicContact CE2-CD1 4.05Å; F612-M624 HydrophobicContact CE1-CG 4.29Å; F612-M624 HydrophobicContact CE2-CG 4.41Å; F612-M624 HydrophobicContact CZ-CG 3.6Å; F612-M624 HydrophobicContact CZ-SD 4.17Å; F612-W627 AromaticContact CD2-CH2 3.7Å; F612-W627 HydrophobicContact CD2-CH2 3.7Å; F612-W627 HydrophobicContact CD2-CZ3 4.04Å; F612-W627 AromaticContact CE2-CH2 3.66Å; F612-W627 HydrophobicContact CE2-CH2 3.66Å; F612-W627 AromaticContact CE2-CZ3 3.74Å; F612-W627 HydrophobicContact CE2-CZ3 3.74Å; F612-W627 HydrophobicContact CZ-CZ3 4.33Å
613	S	63.8	Low	62.2	Low	71 Å²	71	83.4 Å²	83.4	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-69.5	-22.6	-178.9	77	0	0	0	0	114.1	P609 E610 V611 L615 Q620	P609-S613 PolarHBondContact O-N 2.92Å; P609-S613 VanDerWaalsContact O-N 3.14Å; E610-S613 WeakPolarHBondContact O-CB 3.14Å; E610-S613 PolarHBondContact O-N 3.01Å; E610-S613 VanDerWaalsContact O-N 3.09Å; E610-S613 PolarHBondContact O-OG 3.41Å; V611-S613 VanDerWaalsContact C-N 3.31Å; V611-S613 PolarHBondContact O-N 3.21Å; S613-L615 VanDerWaalsContact C-N 3.3Å; S613-Q620 PolarHBondContact O-NE2 3.31Å; S613-Q620 VanDerWaalsContact O-NE2 3.11Å
614	E	67.8	Low	63	Low	167 Å²	167	81.4 Å²	81.4	78%	0.78	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-9.4	176.9	-65.5	-173.1	168.4	0	0	113.5	E610 V611 F612	E610-E614 PolarHBondContact O-N 2.71Å; V611-E614 PolarHBondContact O-N 2.69Å; F612-E614 VanDerWaalsContact C-N 3.28Å; F612-E614 PolarHBondContact O-N 3.48Å
615	L	62.8	Low	63.1	Low	54 Å²	54	82.4 Å²	82.4	28%	0.283	47%	0.466	S	S	.	.	S	Bend	trans	-74	151.1	179.9	-65.7	174.2	0	0	0	111.9	F612 S613 V619 Q620 L623	F612-L615 HydrophobicContact CD2-CD1 4.11Å; F612-L615 WeakPolarHBondContact O-CB 3.42Å; F612-L615 PolarHBondContact O-N 3.44Å; S613-L615 VanDerWaalsContact C-N 3.3Å; L615-V619 HydrophobicContact CD1-CG1 4.37Å; L615-Q620 HydrophobicContact CB-CG 3.81Å; L615-Q620 PolarHBondContact O-NE2 3.29Å; L615-L623 HydrophobicContact CD1-CD1 3.72Å
616	P	72.9	Confident	63.8	Low	76 Å²	76	82.6 Å²	82.6	49%	0.494	44%	0.442	S	S	.	.			trans	-56.8	143.9	171.9	-24.7	34.1	0	0	0	112.2	D618 V619 Q620	P616-D618 PolarHBondContact O-N 2.98Å; P616-D618 VanDerWaalsContact O-N 3.12Å; P616-V619 HydrophobicContact CB-CG2 4.2Å; P616-V619 HydrophobicContact CG-CG2 4.37Å; P616-V619 WeakPolarHBondContact O-CB 3.42Å; P616-V619 PolarHBondContact O-N 3.36Å; P616-Q620 PolarHBondContact O-N 3Å
617	P	62.4	Low	64.6	Low	98 Å²	98	80.9 Å²	80.9	64%	0.636	43%	0.43	S	S	*	.	H	α-helix	trans	-55.2	-36.1	-173.9	-27.7	34.5	0	0	0	114.6	V619 Q620 K621	P617-V619 VanDerWaalsContact C-N 3.31Å; P617-V619 PolarHBondContact O-N 3.47Å; P617-Q620 PolarHBondContact O-N 2.87Å; P617-K621 WeakPolarHBondContact O-CB 3.23Å; P617-K621 PolarHBondContact O-N 3Å
618	D	56.1	Low	64.7	Low	134 Å²	134	86.9 Å²	86.9	72%	0.717	45%	0.453	S	S	*	.	H	α-helix	trans	-66.2	-36.7	179.5	-58.6	-31.3	0	0	0	111.7	P616 K621 E622	P616-D618 PolarHBondContact O-N 2.98Å; P616-D618 VanDerWaalsContact O-N 3.12Å; D618-K621 PolarHBondContact O-N 3.38Å; D618-E622 PolarHBondContact O-N 2.97Å; D618-E622 VanDerWaalsContact O-N 3.08Å
619	V	55	Low	64.1	Low	55 Å²	55	90 Å²	90	33%	0.333	47%	0.465	S	S	.	.	H	α-helix	trans	-74.1	-40.3	178.3	-178.5	0	0	0	0	110.7	L615 P616 P617 K621 E622 L623	L615-V619 HydrophobicContact CD1-CG1 4.37Å; P616-V619 HydrophobicContact CB-CG2 4.2Å; P616-V619 HydrophobicContact CG-CG2 4.37Å; P616-V619 WeakPolarHBondContact O-CB 3.42Å; P616-V619 PolarHBondContact O-N 3.36Å; P617-V619 VanDerWaalsContact C-N 3.31Å; P617-V619 PolarHBondContact O-N 3.47Å; V619-K621 VanDerWaalsContact C-N 3.28Å; V619-K621 PolarHBondContact O-N 3.09Å; V619-E622 PolarHBondContact O-N 3.42Å; V619-L623 HydrophobicContact CG1-CD1 4.01Å; V619-L623 HydrophobicContact CG1-CG 4.5Å; V619-L623 WeakPolarHBondContact O-CB 3.29Å; V619-L623 WeakPolarHBondContact O-CG 3.39Å; V619-L623 PolarHBondContact O-N 2.79Å
620	Q	70.4	Confident	63.5	Low	47 Å²	47	92.5 Å²	92.5	22%	0.22	47%	0.47	C	S	.	.	H	α-helix	trans	-58.8	-42.7	173.4	-65.8	-175	17.5	0	0	111.2	F612 S613 L615 P616 P617 M624	F612-Q620 HydrophobicContact CE1-CB 4Å; F612-Q620 HydrophobicContact CE1-CG 4Å; F612-Q620 HydrophobicContact CE2-CB 4.35Å; F612-Q620 HydrophobicContact CE2-CG 4.43Å; F612-Q620 HydrophobicContact CZ-CB 3.63Å; F612-Q620 HydrophobicContact CZ-CG 3.93Å; F612-Q620 PolarHBondContact O-NE2 3.28Å; S613-Q620 PolarHBondContact O-NE2 3.31Å; S613-Q620 VanDerWaalsContact O-NE2 3.11Å; L615-Q620 HydrophobicContact CB-CG 3.81Å; L615-Q620 PolarHBondContact O-NE2 3.29Å; P616-Q620 PolarHBondContact O-N 3Å; P617-Q620 PolarHBondContact O-N 2.87Å; Q620-M624 WeakPolarHBondContact O-CB 3.44Å; Q620-M624 VanDerWaalsContact O-CG 3.29Å; Q620-M624 WeakPolarHBondContact O-CG 3.43Å; Q620-M624 PolarHBondContact O-N 3.43Å
621	K	65.4	Low	62.4	Low	163 Å²	163	91.3 Å²	91.3	71%	0.709	47%	0.468	S	S	*	.	H	α-helix	trans	-67.1	-40.2	180	-169.5	176.8	-178.6	178.4	0	112.5	P617 D618 V619 S625	P617-K621 WeakPolarHBondContact O-CB 3.23Å; P617-K621 PolarHBondContact O-N 3Å; D618-K621 PolarHBondContact O-N 3.38Å; V619-K621 VanDerWaalsContact C-N 3.28Å; V619-K621 PolarHBondContact O-N 3.09Å; K621-S625 WeakPolarHBondContact O-CB 3.41Å; K621-S625 PolarHBondContact O-N 3.07Å; K621-S625 VanDerWaalsContact O-N 3.09Å
622	E	63.7	Low	61.1	Low	125 Å²	125	94.3 Å²	94.3	58%	0.584	49%	0.489	S	S	*	.	H	α-helix	trans	-63.3	-50.3	175.7	-171.6	172.9	-169.7	0	0	111.2	D618 V619 M624 S625 E626	D618-E622 PolarHBondContact O-N 2.97Å; D618-E622 VanDerWaalsContact O-N 3.08Å; V619-E622 PolarHBondContact O-N 3.42Å; E622-M624 PolarHBondContact O-N 2.7Å; E622-S625 WeakPolarHBondContact O-CB 3.46Å; E622-S625 PolarHBondContact O-N 2.93Å; E622-S625 VanDerWaalsContact O-N 3.16Å; E622-E626 PolarHBondContact O-N 3.21Å
623	L	65.6	Low	59.1	Low	47 Å²	47	99.5 Å²	99.5	25%	0.246	52%	0.522	C	S	.	.	H	α-helix	trans	-61.7	-43.4	179.7	-73.2	169.9	0	0	0	112.8	F612 L615 V619 S625 E626 W627	F612-L623 HydrophobicContact CD2-CD1 4.45Å; F612-L623 HydrophobicContact CE2-CB 4.03Å; F612-L623 HydrophobicContact CE2-CD1 4.05Å; L615-L623 HydrophobicContact CD1-CD1 3.72Å; V619-L623 HydrophobicContact CG1-CD1 4.01Å; V619-L623 HydrophobicContact CG1-CG 4.5Å; V619-L623 WeakPolarHBondContact O-CB 3.29Å; V619-L623 WeakPolarHBondContact O-CG 3.39Å; V619-L623 PolarHBondContact O-N 2.79Å; L623-S625 VanDerWaalsContact C-N 3.31Å; L623-S625 PolarHBondContact O-N 3.42Å; L623-E626 PolarHBondContact O-N 3.39Å; L623-W627 HydrophobicContact CB-CH2 4.3Å; L623-W627 HydrophobicContact CB-CZ2 4.16Å; L623-W627 HydrophobicContact CD2-CZ2 4.38Å; L623-W627 VanDerWaalsContact O-CG 3.26Å; L623-W627 PolarHBondContact O-N 3.33Å
624	M	71.8	Confident	57.4	Low	38 Å²	38	104.1 Å²	104.1	19%	0.187	54%	0.54	C	S	.	.	H	α-helix	trans	-66.6	-33.3	176.9	-73.2	-69.7	-75.1	0	0	112.4	F612 Q620 E622 W627 K628	F612-M624 HydrophobicContact CE1-CG 4.29Å; F612-M624 HydrophobicContact CE2-CG 4.41Å; F612-M624 HydrophobicContact CZ-CG 3.6Å; F612-M624 HydrophobicContact CZ-SD 4.17Å; Q620-M624 WeakPolarHBondContact O-CB 3.44Å; Q620-M624 VanDerWaalsContact O-CG 3.29Å; Q620-M624 WeakPolarHBondContact O-CG 3.43Å; Q620-M624 PolarHBondContact O-N 3.43Å; E622-M624 PolarHBondContact O-N 2.7Å; M624-W627 HydrophobicContact SD-CE3 3.62Å; M624-W627 HydrophobicContact SD-CZ3 3.8Å; M624-K628 WeakPolarHBondContact O-CG 3.41Å; M624-K628 PolarHBondContact O-N 3.4Å; M624-K628 VanDerWaalsContact O-N 3.11Å
625	S	65.4	Low	55.5	Low	62 Å²	62	105.3 Å²	105.3	43%	0.434	54%	0.543	S	S	.	.	H	α-helix	trans	-67.5	-40.4	174.3	-176.2	0	0	0	0	111.3	K621 E622 L623 Q629	K621-S625 WeakPolarHBondContact O-CB 3.41Å; K621-S625 PolarHBondContact O-N 3.07Å; K621-S625 VanDerWaalsContact O-N 3.09Å; E622-S625 WeakPolarHBondContact O-CB 3.46Å; E622-S625 PolarHBondContact O-N 2.93Å; E622-S625 VanDerWaalsContact O-N 3.16Å; L623-S625 VanDerWaalsContact C-N 3.31Å; L623-S625 PolarHBondContact O-N 3.42Å; S625-Q629 WeakPolarHBondContact O-CG 3.41Å; S625-Q629 PolarHBondContact O-N 3.05Å
626	E	62.7	Low	53.8	Low	96 Å²	96	109.2 Å²	109.2	45%	0.449	57%	0.569	S	S	.	*	H	α-helix	trans	-65.1	-42	174.7	-72.2	-166.8	155.8	0	0	112.5	E622 L623 Q629 Q630	E622-E626 PolarHBondContact O-N 3.21Å; L623-E626 PolarHBondContact O-N 3.39Å; E626-Q629 PolarHBondContact O-N 3.24Å; E626-Q630 PolarHBondContact O-N 2.95Å
627	W	70.9	Confident	51.6	Low	42 Å²	42	111.6 Å²	111.6	16%	0.159	58%	0.584	C	S	.	*	H	α-helix	trans	-69.2	-34.2	179.9	-61.9	-20.1	0	0	0	113	F603 P604 V607 F612 L623 M624 Q629 Q630	F603-W627 HydrophobicContact CD1-CZ3 4.25Å; P604-W627 HydrophobicContact CG-CD2 3.9Å; P604-W627 HydrophobicContact CG-CE3 4.29Å; P604-W627 HydrophobicContact CG-CG 4.03Å; V607-W627 HydrophobicContact CB-CH2 4.45Å; V607-W627 HydrophobicContact CG1-CH2 3.82Å; V607-W627 HydrophobicContact CG1-CZ3 4.46Å; V607-W627 HydrophobicContact CG2-CH2 3.96Å; V607-W627 HydrophobicContact CG2-CZ2 3.95Å; F612-W627 AromaticContact CD2-CH2 3.7Å; F612-W627 HydrophobicContact CD2-CH2 3.7Å; F612-W627 HydrophobicContact CD2-CZ3 4.04Å; F612-W627 AromaticContact CE2-CH2 3.66Å; F612-W627 HydrophobicContact CE2-CH2 3.66Å; F612-W627 AromaticContact CE2-CZ3 3.74Å; F612-W627 HydrophobicContact CE2-CZ3 3.74Å; F612-W627 HydrophobicContact CZ-CZ3 4.33Å; L623-W627 HydrophobicContact CB-CH2 4.3Å; L623-W627 HydrophobicContact CB-CZ2 4.16Å; L623-W627 HydrophobicContact CD2-CZ2 4.38Å; L623-W627 VanDerWaalsContact O-CG 3.26Å; L623-W627 PolarHBondContact O-N 3.33Å; M624-W627 HydrophobicContact SD-CE3 3.62Å; M624-W627 HydrophobicContact SD-CZ3 3.8Å; W627-Q629 PolarHBondContact O-N 2.83Å; W627-Q630 PolarHBondContact O-N 3.37Å
628	K	59.4	Low	49.9	Very low	161 Å²	161	112 Å²	112	70%	0.7	59%	0.59	S	S	*	*	H	α-helix	trans	-64	-29.1	172.6	-78.6	-179	179.1	-179.3	0	112.8	M624	M624-K628 WeakPolarHBondContact O-CG 3.41Å; M624-K628 PolarHBondContact O-N 3.4Å; M624-K628 VanDerWaalsContact O-N 3.11Å
629	Q	53.5	Low	48.7	Very low	152 Å²	152	110.5 Å²	110.5	71%	0.71	59%	0.59	S	S	*	*	H	α-helix	trans	-79.2	-17.1	179	-70.5	177.5	18.7	0	0	113.7	S625 E626 W627	S625-Q629 WeakPolarHBondContact O-CG 3.41Å; S625-Q629 PolarHBondContact O-N 3.05Å; E626-Q629 PolarHBondContact O-N 3.24Å; W627-Q629 PolarHBondContact O-N 2.83Å
630	Q	49.6	Very low	47.5	Very low	126 Å²	126	119.5 Å²	119.5	59%	0.589	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-1.7	-175.2	-73.6	-175.4	17.4	0	0	115.3	E626 W627 P632	E626-Q630 PolarHBondContact O-N 2.95Å; W627-Q630 PolarHBondContact O-N 3.37Å; Q630-P632 VanDerWaalsContact O-CD 3.25Å; Q630-P632 WeakPolarHBondContact O-CD 3.44Å
631	N	39	Very low	45.5	Very low	125 Å²	125	126.2 Å²	126.2	67%	0.668	65%	0.646	S	S	*	*			trans	-82.5	111.6	172.6	-83	-28	0	0	0	111	V633	N631-V633 PolarHBondContact O-N 3.14Å
632	P	33.5	Very low	43.8	Very low	119 Å²	119	125 Å²	125	77%	0.773	65%	0.653	S	S	*	*			trans	-75.4	121.4	175.7	-3.5	21.6	0	0	0	109.7	Q630 L634	Q630-P632 VanDerWaalsContact O-CD 3.25Å; Q630-P632 WeakPolarHBondContact O-CD 3.44Å; P632-L634 PolarHBondContact O-N 3.31Å
633	V	28.9	Very low	42	Very low	132 Å²	132	123 Å²	123	80%	0.8	67%	0.665	S	S	*	*			trans	-60.2	115.6	168	175.2	0	0	0	0	109.2	N631 K635	N631-V633 PolarHBondContact O-N 3.14Å; V633-K635 PolarHBondContact O-N 3.03Å; V633-K635 VanDerWaalsContact O-N 3.14Å
634	L	28.8	Very low	40.4	Very low	168 Å²	168	131.4 Å²	131.4	88%	0.88	70%	0.7	S	S	*	*			trans	-61.9	108.7	171.2	-76.8	162.1	0	0	0	110	P632	P632-L634 PolarHBondContact O-N 3.31Å
635	K	27.5	Very low	38.3	Very low	192 Å²	192	132.6 Å²	132.6	84%	0.835	72%	0.722	S	S	*	*			trans	-95.9	108.2	161.9	-76.5	-175.7	178	177.9	0	108.9	V633 P637	V633-K635 PolarHBondContact O-N 3.03Å; V633-K635 VanDerWaalsContact O-N 3.14Å; K635-P637 WeakPolarHBondContact O-CD 3.45Å
636	T	26.6	Very low	36.6	Very low	136 Å²	136	134.9 Å²	134.9	83%	0.834	74%	0.738	S	S	*	*			trans	-71.6	130	167.4	42.5	0	0	0	0	111.1
637	P	28.2	Very low	35.1	Very low	125 Å²	125	137.6 Å²	137.6	81%	0.812	75%	0.754	S	S	*	*			trans	-97.6	132.2	161.2	6.1	14.2	0	0	0	111.8	K635	K635-P637 WeakPolarHBondContact O-CD 3.45Å
638	S	26.9	Very low	33.2	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	79%	0.785	S	S	*	*			trans	-31.8	145.2	166.7	173.4	0	0	0	0	117.7
639	S	30.4	Very low	31.8	Very low	101 Å²	101	143.9 Å²	143.9	71%	0.706	80%	0.797	S	S	*	*			trans	-42.3	139.1	164.1	60.1	0	0	0	0	115.7
640	R	28.6	Very low	30.7	Very low	244 Å²	244	140.3 Å²	140.3	92%	0.921	80%	0.801	S	S	*	*			trans	-167.1	108.1	135.3	-108.4	173.3	-165.1	-175.4	4.5	113.2
641	K	29.1	Very low	29.8	Very low	189 Å²	189	143.4 Å²	143.4	82%	0.822	81%	0.812	S	S	*	*			trans	35.6	122.8	135.8	-77.3	-173.2	175.8	179	0	122.1
642	T	28.7	Very low	29.4	Very low	137 Å²	137	144.3 Å²	144.3	84%	0.84	82%	0.817	S	S	*	*				74.5	123.6	126.6	59.9	0	0	0	0	121.3
643	G	27.5	Very low	29.3	Very low	82 Å²	82	150.6 Å²	150.6	85%	0.845	83%	0.825	S	S	*	*			trans	166.5	92.5	153.2	0	0	0	0	0	113.8
644	K	30.9	Very low	29.3	Very low	225 Å²	225	153.3 Å²	153.3	98%	0.978	83%	0.826	S	S	*	*			trans	-73.6	150.8	175.2	-87.4	176.6	169.8	175.6	0	112.5
645	G	28.6	Very low	29.3	Very low	63 Å²	63	150 Å²	150	65%	0.649	82%	0.823	S	S	*	*			trans	148.6	92	151.8	0	0	0	0	0	112.6
646	S	30.1	Very low	29.4	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	82%	0.819	S	S	*	*				67.9	131	93.5	60.3	0	0	0	0	113
647	I	30.8	Very low	29.4	Very low	154 Å²	154	145.7 Å²	145.7	79%	0.79	82%	0.817	S	S	*	*			cis	-170.1	146.4	11.5	-97.9	156.6	0	0	0	105.3
648	S	30.5	Very low	29.4	Very low	118 Å²	118	151.6 Å²	151.6	83%	0.825	82%	0.823	S	S	*	*			trans	137.6	137.7	135.1	66.7	0	0	0	0	116.2
649	K	31	Very low	29.4	Very low	217 Å²	217	151.7 Å²	151.7	94%	0.943	82%	0.823	S	S	*	*			trans	-70.9	156.3	-166.1	-65.4	162.6	171.6	176.4	0	113.6
650	G	29.3	Very low	29.4	Very low	76 Å²	76	152.7 Å²	152.7	78%	0.784	83%	0.831	S	S	*	*			trans	163.2	68	152.9	0	0	0	0	0	119.2
651	K	31	Very low	29.5	Very low	192 Å²	192	150.4 Å²	150.4	84%	0.835	83%	0.83	S	S	*	*			trans	34.7	114.3	147.1	-81.3	-178.7	166.9	177.8	0	121.8
652	D	30.2	Very low	29.6	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	83%	0.825	S	S	*	*				52.2	97.5	121.9	-55.5	-32.3	0	0	0	120.7
653	R	31.5	Very low	29.7	Very low	250 Å²	250	148 Å²	148	94%	0.943	83%	0.83	S	S	*	*				-140.7	119.4	129.2	-75.5	-163.9	176.2	174	-1.6	110.7	A655	R653-A655 PolarHBondContact O-N 2.74Å
654	K	29.6	Very low	30.2	Very low	189 Å²	189	148.7 Å²	148.7	82%	0.822	81%	0.813	S	S	*	*			trans	-68.7	112.1	178.6	-157.7	178.7	-175.9	-173	0	109.4	E656	K654-E656 WeakPolarHBondContact CE-OE1 3.43Å; K654-E656 IonicContact NZ-OE1 3.09Å
655	A	28.4	Very low	30.5	Very low	98 Å²	98	144.5 Å²	144.5	81%	0.81	80%	0.801	S	S	*	*			trans	-116.9	103.6	167.7	0	0	0	0	0	107.5	R653	R653-A655 PolarHBondContact O-N 2.74Å
656	E	29.6	Very low	30.9	Very low	163 Å²	163	145.3 Å²	145.3	76%	0.762	79%	0.79	S	S	*	*			trans	-85.1	110.7	169.4	-83.7	172.9	-164.9	0	0	108.6	K654	K654-E656 WeakPolarHBondContact CE-OE1 3.43Å; K654-E656 IonicContact NZ-OE1 3.09Å
657	G	26.6	Very low	31.4	Very low	75 Å²	75	147 Å²	147	77%	0.773	78%	0.784	S	S	*	*			trans	-68.8	130.9	171.1	0	0	0	0	0	110.8	S659	G657-S659 PolarHBondContact O-N 3.49Å
658	R	27.5	Very low	31.6	Very low	250 Å²	250	147.2 Å²	147.2	94%	0.943	78%	0.776	S	S	*	*			trans	-73.1	110.9	166.1	-80.6	177.5	168.4	172.1	-3.6	108.9
659	S	28.6	Very low	32	Very low	109 Å²	109	147.4 Å²	147.4	76%	0.762	76%	0.762	S	S	*	*			trans	-77.3	140.4	163.6	56.7	0	0	0	0	110.3	G657 Q661	G657-S659 PolarHBondContact O-N 3.49Å; S659-Q661 PolarHBondContact O-N 3Å
660	S	29.4	Very low	32.1	Very low	123 Å²	123	145.7 Å²	145.7	86%	0.86	76%	0.755	S	S	*	*			trans	-62	119.9	-179.4	-47	0	0	0	0	111.5
661	Q	30.7	Very low	32.3	Very low	195 Å²	195	148.2 Å²	148.2	91%	0.911	76%	0.757	S	S	*	*			trans	-86.8	114.2	172.6	-82.1	-174.4	-30	0	0	110.8	S659	S659-Q661 PolarHBondContact O-N 3Å
662	S	31.5	Very low	32.6	Very low	103 Å²	103	146.4 Å²	146.4	72%	0.72	79%	0.793	S	S	*	*			trans	-66.7	144.8	161.4	42	0	0	0	0	110.7	N664	S662-N664 PolarHBondContact O-N 2.99Å; S662-N664 VanDerWaalsContact O-N 3.1Å
663	N	31.3	Very low	32.7	Very low	174 Å²	174	146.6 Å²	146.6	93%	0.93	79%	0.794	S	S	*	*			trans	-57.2	110.4	174	-75.6	-42.5	0	0	0	110.3
664	N	36.2	Very low	32.8	Very low	95 Å²	95	141.1 Å²	141.1	51%	0.508	79%	0.787	S	S	.	*			trans	-128.5	131.1	171.2	-140	-16.7	0	0	0	109.5	S662 L666	S662-N664 PolarHBondContact O-N 2.99Å; S662-N664 VanDerWaalsContact O-N 3.1Å; N664-L666 PolarHBondContact O-N 2.87Å
665	L	37.2	Very low	33	Very low	138 Å²	138	138.4 Å²	138.4	72%	0.723	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-65.9	-3.5	-175	-84.7	155.3	0	0	0	113.7	K667 Y668	L665-K667 PolarHBondContact O-N 3.17Å; L665-Y668 HydrophobicContact CD2-CD2 4.18Å; L665-Y668 HydrophobicContact CD2-CE2 4.11Å; L665-Y668 PolarHBondContact O-N 3.12Å
666	L	38.5	Very low	33.2	Very low	80 Å²	80	140.8 Å²	140.8	42%	0.419	78%	0.783	S	S	.	*	G	3₁₀ helix	trans	-58.2	-12.1	175.2	-102.5	75.1	0	0	0	115.7	N606 N664 Y668	N606-L666 WeakPolarHBondContact ND2-CD2 3.18Å; N664-L666 PolarHBondContact O-N 2.87Å; L666-Y668 VanDerWaalsContact C-N 3.3Å; L666-Y668 PolarHBondContact O-N 2.88Å
667	K	39.1	Very low	33.5	Very low	143 Å²	143	139.4 Å²	139.4	62%	0.622	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-76.6	-12.7	-177.3	71	176.2	-177.4	178.5	0	114.8	L665	L665-K667 PolarHBondContact O-N 3.17Å
668	Y	35.8	Very low	33.9	Very low	159 Å²	159	143.7 Å²	143.7	62%	0.624	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-89.6	-4.9	-176.5	-68.5	-72.7	0	0	0	114	L665 L666	L665-Y668 HydrophobicContact CD2-CD2 4.18Å; L665-Y668 HydrophobicContact CD2-CE2 4.11Å; L665-Y668 PolarHBondContact O-N 3.12Å; L666-Y668 VanDerWaalsContact C-N 3.3Å; L666-Y668 PolarHBondContact O-N 2.88Å
669	F	38.8	Very low	34.4	Very low	122 Å²	122	136.1 Å²	136.1	54%	0.535	77%	0.774	S	S	.	*			trans	-121.9	74.9	-179.8	-58.1	-78.1	0	0	0	109.7	V611	V611-F669 HydrophobicContact CG1-CD1 4.14Å; V611-F669 HydrophobicContact CG1-CE1 3.8Å
670	K	32.9	Very low	34.8	Very low	182 Å²	182	138.2 Å²	138.2	79%	0.791	78%	0.775	S	S	*	*			trans	-109.3	134.8	163.7	-78.5	-171.9	175.7	-172.3	0	108.2
671	P	34.3	Very low	35.3	Very low	128 Å²	128	139.5 Å²	139.5	83%	0.831	77%	0.768	S	S	*	*			trans	-65.8	145.6	169.1	27.5	-30.6	0	0	0	109.8
672	G	36.8	Very low	35.7	Very low	155 Å²	155	134.5 Å²	134.5	100%	1.598	76%	0.755	S	S	*	*			trans	-68.4	0	174.8	0	0	0	0	0	113.4

Retrieved 672 of 672 residues in 404.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).